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

*Links on SpectraBase are not permalinks.
1-(2H-1-benzothiopyran-3-yl)-1-propanone
SpectraBase Compound ID LNxxPBKoGDu
InChI InChI=1S/C12H12OS/c1-2-11(13)10-7-9-5-3-4-6-12(9)14-8-10/h3-7H,2,8H2,1H3
InChIKey LTGLMEVPYZCSTC-UHFFFAOYSA-N
Mol Weight 204.29 g/mol
Molecular Formula C12H12OS
Exact Mass 204.060886 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 DuBluFttMDn
Name 1-(2H-1-benzothiopyran-3-yl)-1-propanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12OS
InChI InChI=1S/C12H12OS/c1-2-11(13)10-7-9-5-3-4-6-12(9)14-8-10/h3-7H,2,8H2,1H3
InChIKey LTGLMEVPYZCSTC-UHFFFAOYSA-N
Molecular Weight 204.287 g/mol
SMILES C1(=Cc2ccccc2SC1)C(=O)CC
SPLASH splash10-0udi-0090000000-54cd0885b4355fe8e3ab
Source of Spectrum SO-0-2391-6
Synonyms 1-(2H-thiochromen-3-yl)propan-1-one
Wiley ID 878988