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7-(6-Bromohexanoyl)-4-methylcoumarin ester
SpectraBase Compound ID H24bqfkh62z
InChI InChI=1S/C16H17BrO4/c1-11-9-16(19)21-14-10-12(6-7-13(11)14)20-15(18)5-3-2-4-8-17/h6-7,9-10H,2-5,8H2,1H3
InChIKey GOBOSYHGCIWUBV-UHFFFAOYSA-N
Mol Weight 353.21 g/mol
Molecular Formula C16H17BrO4
Exact Mass 352.031022 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FMk24ihS6Qk
Name 7-(6-Bromohexanoyl)-4-methylcoumarin ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17BrO4
InChI InChI=1S/C16H17BrO4/c1-11-9-16(19)21-14-10-12(6-7-13(11)14)20-15(18)5-3-2-4-8-17/h6-7,9-10H,2-5,8H2,1H3
InChIKey GOBOSYHGCIWUBV-UHFFFAOYSA-N
Molecular Weight 353.212 g/mol
SMILES c12OC(=O)C=C(c2ccc(c1)OC(=O)CCCCCBr)C
SPLASH splash10-004i-0901000000-593fc8c75c9e97d82efc
Source of Spectrum J-67-6710-12
Synonyms 6-Bromohexanoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester (4-methyl-2-oxochromen-7-yl) 6-bromohexanoate (4-methyl-2-oxo-chromen-7-yl) 6-bromohexanoate (4-methyl-2-oxidanylidene-chromen-7-yl) 6-bromanylhexanoate
Wiley ID 1570899