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16,17-Dehydroyohimban
SpectraBase Compound ID 2D8J4f6S5kn
InChI InChI=1S/C19H22N2/c1-2-6-14-12-21-10-9-16-15-7-3-4-8-17(15)20-19(16)18(21)11-13(14)5-1/h1,3-5,7-8,13-14,18,20H,2,6,9-12H2/t13-,14-,18-/m0/s1
InChIKey IHUSVLJLHIILOZ-DEYYWGMASA-N
Mol Weight 278.4 g/mol
Molecular Formula C19H22N2
Exact Mass 278.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVU8VGYJJQW
Name 16,17-Dehydroyohimban
Classification Carboline alkaloid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 278.178298716 u
Formula C19H22N2
InChI InChI=1S/C19H22N2/c1-2-6-14-12-21-10-9-16-15-7-3-4-8-17(15)20-19(16)18(21)11-13(14)5-1/h1,3-5,7-8,13-14,18,20H,2,6,9-12H2/t13-,14-,18-/m0/s1
InChIKey IHUSVLJLHIILOZ-DEYYWGMASA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 278.399 g/mol
Nominal Mass 278 u
Quality 890
Retention Index 2474
SMILES [C@]12(C3=C(C=4C(N3)=CC=CC4)CCN2C[C@]2([C@](C1)(C=CCC2)[H])[H])[H]
SPLASH splash10-004i-2890000000-783fcce59e9ac84fc20f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Yohimbinic acid-A (-COOH,-H2O) (4aR,13bS,14aR)-3,4,4a,5,7,8,13,13b,14,14a-decahydroindolo[2',3':3,4]pyrido[1,2-b][2]benzazine
Technique GC/MS
Wiley ID DD2024_000854