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2H-1-Benzothiopyran-3,4-dicarbonitrile, 3,4-dihydro-, trans-
SpectraBase Compound ID VR29jmChWq
InChI InChI=1S/C11H8N2S/c12-5-8-7-14-11-4-2-1-3-9(11)10(8)6-13/h1-4,8,10H,7H2/t8-,10+/m0/s1
InChIKey KDFIGFHYKLVUTD-WCBMZHEXSA-N
Mol Weight 200.26 g/mol
Molecular Formula C11H8N2S
Exact Mass 200.040819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93dE4HvkY76
Name 2H-1-Benzothiopyran-3,4-dicarbonitrile, 3,4-dihydro-, trans-
CAS Registry Number 120783-40-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N2S
InChI InChI=1S/C11H8N2S/c12-5-8-7-14-11-4-2-1-3-9(11)10(8)6-13/h1-4,8,10H,7H2/t8-,10+/m0/s1
InChIKey KDFIGFHYKLVUTD-WCBMZHEXSA-N
Molecular Weight 200.259 g/mol
SMILES [C@]1(c2c(cccc2)SC[C@@]1(C#N)[H])(C#N)[H]
SPLASH splash10-0uka-0950000000-f0d8cbad18c417931904
Source of Spectrum KC-1988-3379-9
Synonyms (3S,4R)-3,4-dihydro-2H-1-benzothiopyran-3,4-dicarbonitrile Thiochroman-trans-3,4-dicarbonitrile
Wiley ID 1197642