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7-Acetyl-2-methyl-2,3-dihydro-(1,5)benzoxazepin-4(5H)-thione

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7-Acetyl-2-methyl-2,3-dihydro-(1,5)benzoxazepin-4(5H)-thione
SpectraBase Compound ID AAPAnyCKSzx
InChI InChI=1S/C12H13NO2S/c1-7-5-12(16)13-10-6-9(8(2)14)3-4-11(10)15-7/h3-4,6-7H,5H2,1-2H3,(H,13,16)
InChIKey IWIJIDVEBJRMKL-UHFFFAOYSA-N
Mol Weight 235.3 g/mol
Molecular Formula C12H13NO2S
Exact Mass 235.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrAS9JJbMuw
Name 1-(6-METHYL-8-THIOXO-6,7,8,9-TETRAHYDRO-5-OXA-9-AZA-BENZOCYCLOHEPTEN-2-YL)ETHANONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H13NO2S
InChI InChI=1S/C12H13NO2S/c1-7-5-12(16)13-10-6-9(8(2)14)3-4-11(10)15-7/h3-4,6-7H,5H2,1-2H3,(H,13,16)
InChIKey IWIJIDVEBJRMKL-UHFFFAOYSA-N
Molecular Weight 235.0664
SMILES N1C(CC(Oc2c1cc(cc2)C(C)=O)C)=S
SPLASH splash10-0f79-8950000000-b86266fdba6dac32edfa
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany