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Yohimbine AC
SpectraBase Compound ID 2CNm3Z2VYAH
InChI InChI=1S/C23H28N2O4/c1-13(26)29-20-8-7-14-12-25-10-9-16-15-5-3-4-6-18(15)24-22(16)19(25)11-17(14)21(20)23(27)28-2/h3-6,14,17,19-21,24H,7-12H2,1-2H3
InChIKey AVICMXMDDSGUEL-UHFFFAOYSA-N
Mol Weight 396.49 g/mol
Molecular Formula C23H28N2O4
Exact Mass 396.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XCh2Ojn6m
Name Yohimbine AC
Classification Sympatholytic
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Exact Mass 396.204907386 u
Formula C23H28N2O4
InChI InChI=1S/C23H28N2O4/c1-13(26)29-20-8-7-14-12-25-10-9-16-15-5-3-4-6-18(15)24-22(16)19(25)11-17(14)21(20)23(27)28-2/h3-6,14,17,19-21,24H,7-12H2,1-2H3
InChIKey AVICMXMDDSGUEL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 396.487 g/mol
SMILES c12c(c3ccccc3[nH]2)CCN2C1CC1C(C(OC(=O)C)CCC1C2)C(=O)OC
SPLASH splash10-0002-0729000000-6c0e120a50b5d430ba88
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_4018