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3-Phenyl-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
SpectraBase Compound ID 2Y0LKr8GjXc
InChI InChI=1S/C17H16N2OS/c20-17-15-13(12-7-3-1-4-8-12)11-21-16(15)18-14-9-5-2-6-10-19(14)17/h1,3-4,7-8,11H,2,5-6,9-10H2
InChIKey TVVSOKALYIIYGY-UHFFFAOYSA-N
Mol Weight 296.39 g/mol
Molecular Formula C17H16N2OS
Exact Mass 296.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cdcnYMWptK
Name 3-Phenyl-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
Alternate Name(s) 5H-Azepino[1,2-a]thieno[2,3-d]pyrimidin-4-one, 4,6,7,8,9,10-hexahydro-3-phenyl- 3-Phenyl-7,8,9,10-tetrahydro-6H-thieno[1,2]pyrimido[4,5-a]azepin-4-one
CAS Registry Number 56929-66-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2OS
InChI InChI=1S/C17H16N2OS/c20-17-15-13(12-7-3-1-4-8-12)11-21-16(15)18-14-9-5-2-6-10-19(14)17/h1,3-4,7-8,11H,2,5-6,9-10H2
InChIKey TVVSOKALYIIYGY-UHFFFAOYSA-N
Molecular Weight 296.388 g/mol
SMILES c12c(N=C3N(C2=O)CCCCC3)scc1-c1ccccc1
SPLASH splash10-0002-1190000000-26939b6ff66a993306df
Source of Spectrum AD-0-2532-0
Wiley ID 1426334