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

*Links on SpectraBase are not permalinks.
2-Acetyl-5,6,6a,7-tetrahydro-7-methoxy-6a-methylthio-8H-azeto[1,2-d]thieno[2,3-b][1,4]thiazepin-8-one
SpectraBase Compound ID 9XKEmdWrBp7
InChI InChI=1S/C13H15NO3S3/c1-7(15)9-6-8-12(20-9)19-5-4-13(18-3)10(17-2)11(16)14(8)13/h6,10H,4-5H2,1-3H3
InChIKey JIPOAURMVHLLBN-UHFFFAOYSA-N
Mol Weight 329.45 g/mol
Molecular Formula C13H15NO3S3
Exact Mass 329.021407 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 IEaoVDUvgS9
Name 2-Acetyl-5,6,6a,7-tetrahydro-7-methoxy-6a-methylthio-8H-azeto[1,2-d]thieno[2,3-b][1,4]thiazepin-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO3S3
InChI InChI=1S/C13H15NO3S3/c1-7(15)9-6-8-12(20-9)19-5-4-13(18-3)10(17-2)11(16)14(8)13/h6,10H,4-5H2,1-3H3
InChIKey JIPOAURMVHLLBN-UHFFFAOYSA-N
Molecular Weight 329.447 g/mol
SMILES C12(N(c3c(SCC2)sc(c3)C(=O)C)C(C1OC)=O)SC
SPLASH splash10-0udi-0095000000-83236eeeec3669ab8715
Source of Spectrum H1-38-1635-19
Synonyms 2-Acetyl-7-methoxy-6a-(methylsulfanyl)-5,6,6a,7-tetrahydro-8H-azeto[1,2-d]thieno[2,3-b][1,4]thiazepin-8-one
Wiley ID 756555