This README.txt file was generated on <20210518> by <CHAU Kwok Hei>

#
# General instructions for completing README: 
# For sections that are non-applicable, mark as N/A (do not delete any sections). 
# Please delete all commented sections after you completed this README . 
#

-------------------
GENERAL INFORMATION
-------------------

1. Title of Dataset:

#
# Authors: CHAU Kwok Hei anson138@hku.hk.
#

2. Author Information
<create a new entry for each additional author>

First Author Contact Information
    Name: CHAU Kwok Hei
    Faculty: Science
    Email: anson138@hku.hk



Corresponding Author Contact Information
    Name: CHAU Kwok Hei
    Faculty: Science
    Email: anson138@hku.hk


Author Contact Information (if applicable)
    Name: N/A
    Faculty: N/A
    Email: N/A


---------------------
DATA & FILE OVERVIEW
---------------------

#
# Directory of Files in Dataset: List and define the different 
# files included in the dataset. This serves as its table of 
# contents. 
#

Directory of Files:
   A. Filename: Synthesis of [3]-, [4]-, [5]- and [6]rotaxanes       
      Short description: HPLC chromatograms, ESI-MS spectra and NMR spectra for the project "Synthesis of [3]-, [4]-, [5]- and [6]rotaxanes"        


        
   B. Filename: Synthesis of [13]catenane       
      Short description: ESI-MS spectra and NMR spectra for the project "Synthesis of [13]catenane"          


        
   C. Filename: N/A       
      Short description: N/A


Additional Notes on File Relationships, Context, or Content 
(for example, if a user wants to reuse and/or cite your data, 
what information would you want them to know?): N/A              


#
# File Naming Convention: Define your File Naming Convention 
# (FNC), the framework used for naming your files systematically 
# to describe what they contain, which could be combined with the
# Directory of Files. 
#

File Naming Convention: N/A


#
# Data Description: A data description, dictionary, or codebook
# defines the variables and abbreviations used in a dataset. This
# information can be included in the README file, in a separate 
# file, or as part of the data file. If it is in a separate file
# or in the data file, explain where this information is located
# and ensure that it is accessible without specialized software.
# (We recommend using plain text files or tabular plain text CSV
# files exported from spreadsheet software.) 
#

-----------------------------------------
DATA DESCRIPTION FOR: N/A
-----------------------------------------
<create sections for each dataset included>


1. Number of variables:


2. Number of cases/rows: 


3. Missing data codes:
        Code/symbol        Definition
        Code/symbol        Definition


4. Variable List

#
# Example. Name: Gender 
#     Description: Gender of respondent
#         1 = Male
#         2 = Female
#         3 = Transgender
#	      4 = Nonbinary
#		  5 = Other gender not listed 
#		  6 = Prefer not to answer
#

    A. Name: <variable name>
       Description: <description of the variable>
                    Value labels if appropriate


    B. Name: <variable name>
       Description: <description of the variable>
                    Value labels if appropriate

--------------------------
METHODOLOGICAL INFORMATION
--------------------------

#
# Software: If specialized software(s) generated your data or
# are necessary to interpret it, please provide for each (if
# applicable): software name, version, system requirements,
# and developer. 
#If you developed the software, please provide (if applicable): 
#A copy of the software’s binary executable compatible with the system requirements described above. 
#A source snapshot or distribution if the source code is not stored in a publicly available online repository.
#All software source components, including pointers to source(s) for third-party components (if any)

1. Software-specific information:
<create a new entry for each qualifying software program>

Name: MestReNova
Version:12.0.4-22023
System Requirements: Windows 7 or higher
 OS X 10.13 or higher.
 Pentium 300 MHz, 128MB RAM, Video Adapter Super VGA (800 x 600) with X11, OpenSSL and OpenGL libraries.
Open Source? (Y/N): N

(if available and applicable)
Executable URL:
Source Repository URL:
Developer: Mestrelab Research
Product URL: https://mestrelab.com/download/mnova/
Software source components:

Name: DataAnalysisViewer
Version: 4.1 (Build 362.7)
System Requirements: Windows 7 or higher
 OS X 10.13 or higher.
 Pentium 300 MHz, 128MB RAM, Video Adapter Super VGA (800 x 600) with X11, OpenSSL and OpenGL libraries.
Open Source? (Y/N): N

(if available and applicable)
Executable URL:
Source Repository URL:
Developer: Bruker Daltonik Gmbh
Product URL:
Software source components:



Additional Notes(such as, will this software not run on 
certain operating systems?):


#
# Equipment: If specialized equipment generated your data,
# please provide for each (if applicable): equipment name,
# manufacturer, model, and calibration information. Be sure
# to include specialized file format information in the data
# dictionary.
#

2. Equipment-specific information:
<create a new entry for each qualifying piece of equipment>

Manufacturer:
Model:

(if applicable)
Embedded Software / Firmware Name:
Embedded Software / Firmware Version:
Additional Notes: