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2,2-Dimethyl-5,5-dihydroxy-6-(isopentoyl)-8-(3-methyl-2-buten-1-yl)chroman-7-one

View entire compound with spectra: 1 MS (GC)

2,2-Dimethyl-5,5-dihydroxy-6-(isopentoyl)-8-(3-methyl-2-buten-1-yl)chroman-7-one
SpectraBase Compound ID 5SSiwXfc5iD
InChI InChI=1S/C21H30O5/c1-12(2)7-8-14-18(23)17(16(22)11-13(3)4)21(24,25)15-9-10-20(5,6)26-19(14)15/h7,9-10,13-14,17,24-25H,8,11H2,1-6H3
InChIKey LZXYKBKPVIIILZ-UHFFFAOYSA-N
Mol Weight 362.47 g/mol
Molecular Formula C21H30O5
Exact Mass 362.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5trMZahqi1i
Name 2,2-Dimethyl-5,5-dihydroxy-6-(isopentoyl)-8-(3-methyl-2-buten-1-yl)chroman-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O5
InChI InChI=1S/C21H30O5/c1-12(2)7-8-14-18(23)17(16(22)11-13(3)4)21(24,25)15-9-10-20(5,6)26-19(14)15/h7,9-10,13-14,17,24-25H,8,11H2,1-6H3
InChIKey LZXYKBKPVIIILZ-UHFFFAOYSA-N
Molecular Weight 362.466 g/mol
SMILES OC1(C2=C(C(C(=O)C1C(CC(C)C)=O)CC=C(C)C)OC(C=C2)(C)C)O
SPLASH splash10-0adi-9710000000-30f2a301d7e86a653ccb
Source of Spectrum KC-1982-381-0
Synonyms 5,5-Dihydroxy-2,2-dimethyl-6-(3-methylbutanoyl)-8-(3-methyl-2-butenyl)-2,5,6,8-tetrahydro-7H-chromen-7-one
Wiley ID 1349735