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3,7-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one
SpectraBase Compound ID 101vOxy7lxZ
InChI InChI=1S/C11H12O2/c1-7-3-4-9-6-8(2)13-11(12)10(9)5-7/h3-5,8H,6H2,1-2H3
InChIKey GWRJNTINTSZDDB-UHFFFAOYSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SHLv9vnNFP
Name 3,7-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one
Alternate Name(s) 3,7-dimethyl-3,4-dihydroisochromen-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-7-3-4-9-6-8(2)13-11(12)10(9)5-7/h3-5,8H,6H2,1-2H3
InChIKey GWRJNTINTSZDDB-UHFFFAOYSA-N
Molecular Weight 176.215 g/mol
SMILES C1(c2c(ccc(c2)C)CC(O1)C)=O
SPLASH splash10-003r-0900000000-e6e58671b36db33e213b
Source of Spectrum H1-38-1514-7
Wiley ID 756369