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BLGXFZZNTVWLAY-UHFFFAOYSA-N
SpectraBase Compound ID 29Fi8LoSvQv
InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3
InChIKey BLGXFZZNTVWLAY-UHFFFAOYSA-N
Mol Weight 354.45 g/mol
Molecular Formula C21H26N2O3
Exact Mass 354.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fq4oel5PK9I
Name Yohimbine
CAS Registry Number 146-48-5
Classification Sympatholytic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 354.194342702 u
Formula C21H26N2O3
InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3
InChIKey BLGXFZZNTVWLAY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 354.450 g/mol
SMILES c1cccc2[nH]c3c(c12)CCN1C3CC2C(C1)CCC(C2C(=O)OC)O
SPLASH splash10-0udi-1729000000-c1aa01a80c4a75abad6b
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_3995