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3-Benzyl-4-hydroxycoumarin
SpectraBase Compound ID LXXmcA1A9L0
InChI InChI=1S/C16H12O3/c17-15-12-8-4-5-9-14(12)19-16(18)13(15)10-11-6-2-1-3-7-11/h1-9,17H,10H2
InChIKey AEIVRFFWQSJCAR-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C16H12O3
Exact Mass 252.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lt4PWaMfiPv
Name 3-Benzyl-4-hydroxycoumarin
Alternate Name(s) 3-Benzyl-4-hydroxy-2H-chromen-2-one 4-Hydroxy-3-(phenylmethyl)-1-benzopyran-2-one 3-Benzyl-4-hydroxychromen-2-one 3-Benzyl-4-hydroxy-chromen-2-one 4-Oxidanyl-3-(phenylmethyl)chromen-2-one
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Formula C16H12O3
InChI InChI=1S/C16H12O3/c17-15-12-8-4-5-9-14(12)19-16(18)13(15)10-11-6-2-1-3-7-11/h1-9,17H,10H2
InChIKey AEIVRFFWQSJCAR-UHFFFAOYSA-N
Molecular Weight 252.269 g/mol
SMILES OC1=C(C(Oc2ccccc12)=O)Cc1ccccc1
SPLASH splash10-0fk9-3890000000-3d94e0c965462617355f
Source of Spectrum OP-29-225-3
Wiley ID 850844