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6-Bromoisochroman-1-one
SpectraBase Compound ID CVLBwtU3BTT
InChI InChI=1S/C9H7BrO2/c10-7-1-2-8-6(5-7)3-4-12-9(8)11/h1-2,5H,3-4H2
InChIKey UPAPBCUWEGCRAG-UHFFFAOYSA-N
Mol Weight 227.06 g/mol
Molecular Formula C9H7BrO2
Exact Mass 225.962942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XfXudASe0
Name 6-Bromoisochroman-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7BrO2
InChI InChI=1S/C9H7BrO2/c10-7-1-2-8-6(5-7)3-4-12-9(8)11/h1-2,5H,3-4H2
InChIKey UPAPBCUWEGCRAG-UHFFFAOYSA-N
Molecular Weight 227.057 g/mol
SMILES C1(c2c(cc(cc2)Br)CCO1)=O
SPLASH splash10-004i-3590000000-22639bcd1185cc0fe3df
Source of Spectrum U1-2009-2530-7c
Synonyms 6-Bromo-3,4-dihydro-1H-2-benzopyran-1-one 6-Bromo-3,4-dihydroisochromen-1-one
Wiley ID 1663077