Electron impact MS

DOI: 10.14469/hpc/10223 Metadata

Created: 2022-03-11 13:54

Last modified: 2022-03-12 08:58

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

raw mass spectroscopic dataset

Files

FilenameSizeTypeDescription
Anthracene.cdxml 5KB chemical/x-cdxml Chemdraw connection table
TMSCCI.cdxml 4KB chemical/x-cdxml Chemdraw connection table
Anthracene.zip 135KB application/zip Raw data archive
Anthracene.mnpub 0 chemical/x-mnpub Mestrenova signature file for Anthracene.zip
TMSCCI.zip 126KB application/zip Raw data archive
TMSCCI.mnpub 0 chemical/x-mnpub Mestrenova signature file for TMSCCI.zip

Member of collection / collaboration

DOIDescription
10.14469/hpc/10222 Mass spectroscopic data for "A combined DFT-predictive and experimental exploration of the sensitivity towards nucleofuge variation in zwitterionic intermediates relating to mechanistic models for unimolecular chemical generation and trapping of free C2 and alternative bimolecular pathways involving no free C2."

Subject Keywords

KeywordValue
inchi InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H
inchi InChI=1S/C5H9ISi/c1-7(2,3)5-4-6/h1-3H3
inchikey MWPLVEDNUUSJAV-UHFFFAOYSA-N
inchikey HNIRHTRSZDSMOF-UHFFFAOYSA-N

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