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(1''RS)-4-HYDROXY-3-[(2-METHYL-5-(1-METHYLETHYL)-2,4-CYClOHEXADIENYL)-METHYL]-2H-[1]-BENZOPYRAN-2-ONE
SpectraBase Compound ID 8Gv7eOy31vp
InChI InChI=1S/C20H22O3/c1-12(2)14-9-8-13(3)15(10-14)11-17-19(21)16-6-4-5-7-18(16)23-20(17)22/h4-9,12,15,21H,10-11H2,1-3H3
InChIKey JUXSJNAQDTTYLM-UHFFFAOYSA-N
Mol Weight 310.39 g/mol
Molecular Formula C20H22O3
Exact Mass 310.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8QC507r9eWu
Name (1"RS)-4-Hydroxy-3-[(2-methyl-5-(1-methylethyl)-2,4-cyclohexadienyl)methyl]-2H-[1]benzopyran-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C20H22O3
InChI InChI=1S/C20H22O3/c1-12(2)14-9-8-13(3)15(10-14)11-17-19(21)16-6-4-5-7-18(16)23-20(17)22/h4-9,12,15,21H,10-11H2,1-3H3
InChIKey JUXSJNAQDTTYLM-UHFFFAOYSA-N
Molecular Weight 310.393 g/mol
SMILES OC1=C(C(Oc2ccccc12)=O)CC1C(=CC=C(C1)C(C)C)C
SPLASH splash10-004i-0900000000-38eb2d250eac60e6240b
Source of Spectrum J-59-5564-30
Synonyms (1''RS)-4-Hydroxy-3-[(2-methyl-5-(1-methylethyl)-2,4-cyclohexadienyl)methyl]-2H-[1]benzopyran-2-one 4-hydroxy-3-[(5-isopropyl-2-methyl-2,4-cyclohexadien-1-yl)methyl]-2H-chromen-2-one 4-hydroxy-3-[(2-methyl-5-propan-2-yl-1-cyclohexa-2,4-dienyl)methyl]-1-benzopyran-2-one 4-hydroxy-3-[(2-methyl-5-propan-2-ylcyclohexa-2,4-dien-1-yl)methyl]chromen-2-one 4-hydroxy-3-[(5-isopropyl-2-methyl-cyclohexa-2,4-dien-1-yl)methyl]chromen-2-one 3-[(2-methyl-5-propan-2-yl-cyclohexa-2,4-dien-1-yl)methyl]-4-oxidanyl-chromen-2-one
Wiley ID 1311885