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(+-)-1-Phenylsulfanyl-6,7,10,10a-tetrahydro-3H-pyrido-[1,2-a]azepin-4-one
SpectraBase Compound ID Hx3EbbaaqB5
InChI InChI=1S/C16H17NOS/c18-16-11-10-15(19-13-7-3-1-4-8-13)14-9-5-2-6-12-17(14)16/h1-5,7-8,10,14H,6,9,11-12H2
InChIKey XPUKOOXAFYMILR-UHFFFAOYSA-N
Mol Weight 271.38 g/mol
Molecular Formula C16H17NOS
Exact Mass 271.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UQSKISINAa
Name (+-)-1-Phenylsulfanyl-6,7,10,10a-tetrahydro-3H-pyrido-[1,2-a]azepin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NOS
InChI InChI=1S/C16H17NOS/c18-16-11-10-15(19-13-7-3-1-4-8-13)14-9-5-2-6-12-17(14)16/h1-5,7-8,10,14H,6,9,11-12H2
InChIKey XPUKOOXAFYMILR-UHFFFAOYSA-N
Molecular Weight 271.378 g/mol
SMILES C12N(C(CC=C2Sc2ccccc2)=O)CCC=CC1
SPLASH splash10-0fe0-1790000000-109dfb4d1dfb420877ba
Source of Spectrum F-70-8633-9x
Synonyms 1-(Phenylthio)-6,7,10,10a-tetrahydropyrido[1,2-a]azepin-4(3H)-one
Wiley ID 1743234