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3-Chloro-6-methyl-6,7-dihydro-9H-5-oxa-9-azabenzocyclohepten-8-one
SpectraBase Compound ID CbxIw8W93vm
InChI InChI=1S/C10H10ClNO2/c1-6-4-10(13)12-8-3-2-7(11)5-9(8)14-6/h2-3,5-6H,4H2,1H3,(H,12,13)
InChIKey OBYMSPNSAICJJD-UHFFFAOYSA-N
Mol Weight 211.65 g/mol
Molecular Formula C10H10ClNO2
Exact Mass 211.040006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EmTPcYHvmW5
Name 3-Chloro-6-methyl-6,7-dihydro-9H-5-oxa-9-azabenzocyclohepten-8-one
CAS Registry Number 134076-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10ClNO2
InChI InChI=1S/C10H10ClNO2/c1-6-4-10(13)12-8-3-2-7(11)5-9(8)14-6/h2-3,5-6H,4H2,1H3,(H,12,13)
InChIKey OBYMSPNSAICJJD-UHFFFAOYSA-N
Molecular Weight 211.648 g/mol
SMILES N1c2ccc(cc2OC(CC1=O)C)Cl
SPLASH splash10-014l-9510000000-d239df87bc502f5dad29
Synonyms 8-Chloranyl-2-methyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one 8-Chloro-2-methyl-2,3-dihydro-1,5-benzoxazepin-4(5H)-one 8-Chloro-2-methyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one
Wiley ID 1475613