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3-Bromo-6-methyl-6,7-dihydro-9H-5-oxa-9-azabenzocyclohepten-8-one
SpectraBase Compound ID 5cwuZPln5bY
InChI InChI=1S/C10H10BrNO2/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 WVHRVHNRGNTGHM-UHFFFAOYSA-N
Mol Weight 256.1 g/mol
Molecular Formula C10H10BrNO2
Exact Mass 254.989492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVfN7ZjlVt8
Name 3-BROMO-6-METHYL-6,7-DIHYDRO-9H-5-OXA-9-AZA-BENZOCYCLOHEPTEN-8-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H10BrNO2
InChI InChI=1S/C10H10BrNO2/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 WVHRVHNRGNTGHM-UHFFFAOYSA-N
Molecular Weight 254.9892
SMILES N1C(CC(Oc2cc(ccc12)Br)C)=O
SPLASH splash10-014i-9210000000-e98955c1dce16dbcdb63
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany