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Methyl pseudo-17-hydroxyyohimban-17-en-18-carboxylic acid
SpectraBase Compound ID 4slwVQAWOcm
InChI InChI=1S/C21H24N2O3/c1-26-21(25)16-8-13-11-23-7-6-15-14-4-2-3-5-17(14)22-20(15)18(23)9-12(13)10-19(16)24/h2-5,12-13,18,22,24H,6-11H2,1H3/t12-,13+,18-/m1/s1
InChIKey NMEJTYRFWQPPQN-FHSNZYRGSA-N
Mol Weight 352.43 g/mol
Molecular Formula C21H24N2O3
Exact Mass 352.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9lQN1wDPBo1
Name Methyl pseudo-17-hydroxyyohimban-17-en-18-carboxylic acid
Alternate Name(s) Methyl (3beta)-17-hydroxy-17,18-didehydroyohimban-18-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N2O3
InChI InChI=1S/C21H24N2O3/c1-26-21(25)16-8-13-11-23-7-6-15-14-4-2-3-5-17(14)22-20(15)18(23)9-12(13)10-19(16)24/h2-5,12-13,18,22,24H,6-11H2,1H3/t12-,13+,18-/m1/s1
InChIKey NMEJTYRFWQPPQN-FHSNZYRGSA-N
Molecular Weight 352.434 g/mol
SMILES [nH]1c2ccccc2c2c1[C@]1(C[C@]3([C@@](CC(=C(C3)O)C(=O)OC)(CN1CC2)[H])[H])[H]
SPLASH splash10-0006-8900000000-8cf83cd0f2de82e28b62
Source of Spectrum C-101-5375-0
Wiley ID 1343424