For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5H-Pyrrolo[1,2-c]imidazolium, 6,7-dihydro-1-mercapto-2,3-diphenyl-, hydroxide, inner salt
SpectraBase Compound ID 1a5kRfGmt7P
InChI InChI=1S/C18H16N2S/c21-18-16-12-7-13-19(16)17(14-8-3-1-4-9-14)20(18)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChIKey VCJQUXGHDCAFMN-UHFFFAOYSA-N
Mol Weight 292.4 g/mol
Molecular Formula C18H16N2S
Exact Mass 292.10342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6WMLdPMUaQo
Name 5H-Pyrrolo[1,2-c]imidazolium, 6,7-dihydro-1-mercapto-2,3-diphenyl-, hydroxide, inner salt
CAS Registry Number 60026-90-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2S
InChI InChI=1S/C18H16N2S/c21-18-16-12-7-13-19(16)17(14-8-3-1-4-9-14)20(18)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChIKey VCJQUXGHDCAFMN-UHFFFAOYSA-N
Molecular Weight 292.400 g/mol
SMILES c1([n+]2c(c([n]1-c1ccccc1)[S-])CCC2)-c1ccccc1
SPLASH splash10-004i-9300000000-34cafe2b0c20dacf9cd4
Source of Spectrum F-32-581-0
Synonyms 2,3-Diphenyl-2H,5H,6H,7H-pyrrolo[1,2-c]imidazol-4-ium-1-thiolate 2,3-Diphenyl-2H,5H,6H,7H-pyrrolo[1,2-c]imidazol-4-ium-1-ylsulfide Anhydro-2-phenyl-5-thio-3,4-trimethylene-1,3-diazolium hydroxide
Wiley ID 1295688