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

*Links on SpectraBase are not permalinks.
4-Isopropenyl-2-(3-methyl-2-butenyl)-3,4-dihydro-2H-benzo[b]thiine-2-carbonitrile
SpectraBase Compound ID HxoUwS0emzg
InChI InChI=1S/C18H21NS/c1-13(2)9-10-18(12-19)11-16(14(3)4)15-7-5-6-8-17(15)20-18/h5-9,16H,3,10-11H2,1-2,4H3
InChIKey UNXFIZOIZOANOK-UHFFFAOYSA-N
Mol Weight 283.43 g/mol
Molecular Formula C18H21NS
Exact Mass 283.139471 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 JFekYfAFFgA
Name 4-Isopropenyl-2-(3-methyl-2-butenyl)-3,4-dihydro-2H-benzo[b]thiine-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NS
InChI InChI=1S/C18H21NS/c1-13(2)9-10-18(12-19)11-16(14(3)4)15-7-5-6-8-17(15)20-18/h5-9,16H,3,10-11H2,1-2,4H3
InChIKey UNXFIZOIZOANOK-UHFFFAOYSA-N
Molecular Weight 283.433 g/mol
SMILES C1(Sc2c(C(C1)C(=C)C)cccc2)(C#N)CC=C(C)C
SPLASH splash10-014i-4390000000-df311e41a5f5015b4791
Source of Spectrum QA-48-340-28
Synonyms 4-isopropenyl-2-(3-methyl-2-butenyl)-3,4-dihydro-2H-1-benzothiopyran-2-carbonitrile
Wiley ID 863470