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

*Links on SpectraBase are not permalinks.
4-Iodo-3-methyl-5-phenethyl-7H-thieno[2,3-c]pyran-7-one
SpectraBase Compound ID B4KlX2AblER
InChI InChI=1S/C16H13IO2S/c1-10-9-20-15-13(10)14(17)12(19-16(15)18)8-7-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3
InChIKey PECNGTRBCOCPGK-UHFFFAOYSA-N
Mol Weight 396.24 g/mol
Molecular Formula C16H13IO2S
Exact Mass 395.968096 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 93UWWN1cFVg
Name 4-Iodo-3-methyl-5-phenethyl-7H-thieno[2,3-c]pyran-7-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13IO2S
InChI InChI=1S/C16H13IO2S/c1-10-9-20-15-13(10)14(17)12(19-16(15)18)8-7-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3
InChIKey PECNGTRBCOCPGK-UHFFFAOYSA-N
Instrument Name GC??MS apparatus
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000468
Molecular Weight 396.242 g/mol
Reported Formula C16H13IO2S
SMILES C=1(I)c2c(C(OC1CCc1ccccc1)=O)scc2C
SPLASH splash10-0006-9024000000-4fa7cd3fa74444bf85b9
Source of Spectrum U1-2020-3722-2k
Wiley ID 1860745