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Stigmasterol
SpectraBase Compound ID KqOiD6MQIMq
InChI InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3
InChIKey HCXVJBMSMIARIN-UHFFFAOYSA-N
Mol Weight 412.7 g/mol
Molecular Formula C29H48O
Exact Mass 412.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3s1n27UcZC3
Name Stigmasterol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H48O
InChI InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3
InChIKey HCXVJBMSMIARIN-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 412.702 g/mol
SMILES OC1CC2=CCC3C(CCC4(C)C(C(C=CC(CC)C(C)C)C)CCC34)C2(C)CC1
SPLASH splash10-0a59-9731000000-1cce9fad5202155dc16d
Source of Spectrum SRH-2022-8291-0
Wiley ID 1829993