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2-Cyclopenten-1-one, 3,4,5-trihydroxy-5-(3-methyl-2-butenyl)-2-(3-methyl-1-oxobutyl)-
SpectraBase Compound ID 8DGjol5qqO0
InChI InChI=1S/C15H22O5/c1-8(2)5-6-15(20)13(18)11(12(17)14(15)19)10(16)7-9(3)4/h5,9,14,17,19-20H,6-7H2,1-4H3
InChIKey QSHUUGSBRMSXKV-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C15H22O5
Exact Mass 282.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85rIvR4Xv48
Name 2-Cyclopenten-1-one, 3,4,5-trihydroxy-5-(3-methyl-2-butenyl)-2-(3-methyl-1-oxobutyl)-
Alternate Name(s) 3,4,5-Trihydroxy-2-(3-methylbutanoyl)-5-(3-methyl-2-butenyl)-2-cyclopenten-1-one 2-Cyclopenten-1-one, 3,4,5-trihydroxy-2-isovaleryl-5-(3-methyl-2-butenyl)- Oxyhumulinic acid
CAS Registry Number 469-30-7
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O5
InChI InChI=1S/C15H22O5/c1-8(2)5-6-15(20)13(18)11(12(17)14(15)19)10(16)7-9(3)4/h5,9,14,17,19-20H,6-7H2,1-4H3
InChIKey QSHUUGSBRMSXKV-UHFFFAOYSA-N
Molecular Weight 282.336 g/mol
SMILES OC1(C(C(=C(C1=O)C(CC(C)C)=O)O)O)CC=C(C)C
SPLASH splash10-0296-9420000000-6da7af51c1b75f79d1ec
Source of Spectrum O-6-983-3
Wiley ID 1285764