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2(1H)-Azocinone, 1-acetylhexahydro-3-(phenylsulfinyl)-
SpectraBase Compound ID GEaCBWAIUeB
InChI InChI=1S/C15H19NO3S/c1-12(17)16-11-7-3-6-10-14(15(16)18)20(19)13-8-4-2-5-9-13/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3
InChIKey YVRBMEKBDYUASZ-UHFFFAOYSA-N
Mol Weight 293.38 g/mol
Molecular Formula C15H19NO3S
Exact Mass 293.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQ1GMKaqxym
Name 2(1H)-Azocinone, 1-acetylhexahydro-3-(phenylsulfinyl)-
CAS Registry Number 78411-36-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO3S
InChI InChI=1S/C15H19NO3S/c1-12(17)16-11-7-3-6-10-14(15(16)18)20(19)13-8-4-2-5-9-13/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3
InChIKey YVRBMEKBDYUASZ-UHFFFAOYSA-N
Molecular Weight 293.381 g/mol
SMILES C1(N(C(=O)C)CCCCCC1S(=O)c1ccccc1)=O
SPLASH splash10-00mo-9700000000-89a6c533cfffeab5a188
Source of Spectrum B-34-578-0
Synonyms 1-Acetyl-3-(phenylsulfinyl)hexahydro-2(1H)-azocinone N-acetyl-3-phenylsulfinylhexahydroazocin-2(1H)-one
Wiley ID 1296249