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3-EPI-LUPEOL
SpectraBase Compound ID EPr4BVXrDsS
InChI InChI=1S/C30H50O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-25,31H,1,9-18H2,2-8H3
InChIKey MQYXUWHLBZFQQO-UHFFFAOYSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AEVtwtZzqGQ
Name lup-20-en-3-.beta.-ol
Alternate Name(s) Lupeol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-25,31H,1,9-18H2,2-8H3
InChIKey MQYXUWHLBZFQQO-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 426.729 g/mol
SMILES OC1CCC2(C(CCC3(C2CCC2C3(CCC3(C2C(C(C)=C)CC3)C)C)C)C1(C)C)C
SPLASH splash10-056r-3951300000-9ac6ecfebcc99d713b84
Source of Spectrum SRH-2022-2091-0
Wiley ID 1824460