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[1]Benzothiepino[2,3-b]pyridin-6(5H)-one
SpectraBase Compound ID I67q8LALIWX
InChI InChI=1S/C13H9NOS/c15-11-8-9-4-3-7-14-13(9)16-12-6-2-1-5-10(11)12/h1-7H,8H2
InChIKey DDYRSPIHMLJVBH-UHFFFAOYSA-N
Mol Weight 227.28 g/mol
Molecular Formula C13H9NOS
Exact Mass 227.040485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ePz6jBu5KP
Name [1]Benzothiepino[2,3-b]pyridin-6(5H)-one
CAS Registry Number 43003-95-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9NOS
InChI InChI=1S/C13H9NOS/c15-11-8-9-4-3-7-14-13(9)16-12-6-2-1-5-10(11)12/h1-7H,8H2
InChIKey DDYRSPIHMLJVBH-UHFFFAOYSA-N
Molecular Weight 227.281 g/mol
SMILES c1ccc2C(=O)Cc3c(Sc2c1)nccc3
SPLASH splash10-004i-6690000000-aa3353b496170e8c7130
Source of Spectrum AD-0-2532-0
Synonyms 5H-[1]benzothiepino[2,3-b]pyridin-6-one [1]-Benzothiepino[2,3-b]pyridine-6(5H)-one
Wiley ID 1429454