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GRAVELLIFERONE
SpectraBase Compound ID 6crkd3o5yip
InChI InChI=1S/C19H22O3/c1-6-19(4,5)15-10-14-9-13(8-7-12(2)3)16(20)11-17(14)22-18(15)21/h6-7,9-11,20H,1,8H2,2-5H3
InChIKey HEPYYVMIJBDNIM-UHFFFAOYSA-N
Mol Weight 298.38 g/mol
Molecular Formula C19H22O3
Exact Mass 298.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36kp6UnYuBT
Name 3-(1,1-Dimethylallyl)-7-hydroxy-6-(3-methylbut-2-enyl)coumarin
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O3
InChI InChI=1S/C19H22O3/c1-6-19(4,5)15-10-14-9-13(8-7-12(2)3)16(20)11-17(14)22-18(15)21/h6-7,9-11,20H,1,8H2,2-5H3
InChIKey HEPYYVMIJBDNIM-UHFFFAOYSA-N
Molecular Weight 298.382 g/mol
SMILES Oc1c(cc2c(c1)OC(C(=C2)C(C=C)(C)C)=O)CC=C(C)C
SPLASH splash10-001m-0090000000-3aa44c704005728742d4
Source of Spectrum KC-0-3107-12
Synonyms 3-(1,1-dimethylallyl)-7-hydroxy-6-(3-methylbut-2-enyl)chromen-2-one 3-(2-Methylbut-3-en-2-yl)-6-(3-methylbut-2-enyl)-7-oxidanyl-chromen-2-one 7-Hydroxy-3-(2-methylbut-3-en-2-yl)-6-(3-methylbut-2-enyl)-1-benzopyran-2-one 7-Hydroxy-3-(2-methylbut-3-en-2-yl)-6-(3-methylbut-2-enyl)chromen-2-one
Wiley ID 782494