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

*Links on SpectraBase are not permalinks.
[2.0.2.0]-(2,5)-THIOPHENOPHAN-1,11-DIENE
SpectraBase Compound ID 6fCLztq70Wy
InChI InChI=1S/C20H12S4/c1-2-14-6-10-19(22-14)20-12-8-16(24-20)4-3-15-7-11-18(23-15)17-9-5-13(1)21-17/h1-12H/b2-1-,4-3-,13-1-,14-2-,15-3-,16-4-,18-17-,20-19-
InChIKey MSROBQXQQZEQGQ-WGMILTDNSA-N
Mol Weight 380.6 g/mol
Molecular Formula C20H12S4
Exact Mass 379.982185 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 FeJqx3xCAdf
Name Tetrathiaporphycene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12S4
InChI InChI=1S/C20H12S4/c1-2-14-6-10-19(22-14)20-12-8-16(24-20)4-3-15-7-11-18(23-15)17-9-5-13(1)21-17/h1-12H/b2-1-,4-3-,13-1-,14-2-,15-3-,16-4-,18-17-,20-19-
InChIKey MSROBQXQQZEQGQ-WGMILTDNSA-N
Molecular Weight 380.556 g/mol
SMILES c12-c3sc(\C=C/c4sc(-c5sc(\C=C/c(s2)cc1)cc5)cc4)cc3
SPLASH splash10-001i-0009000000-948120dcb72cee305244
Source of Spectrum J-59-8074-6
Synonyms [2.0.2.0](2,5)-Thiohenophane-1,11-diene 21,22,23,24-tetrathiapentacyclo[16.2.1.1(2,5).1(8,11).1(12,15)]tetracosa-1(20),2,4,6,8,10,12,14,16,18-decaene
Wiley ID 1359624