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Ethaverine
SpectraBase Compound ID IGWudT0VTBV
InChI InChI=1S/C24H29NO4/c1-5-26-21-10-9-17(14-22(21)27-6-2)13-20-19-16-24(29-8-4)23(28-7-3)15-18(19)11-12-25-20/h9-12,14-16H,5-8,13H2,1-4H3
InChIKey ZOWYFYXTIWQBEP-UHFFFAOYSA-N
Mol Weight 395.5 g/mol
Molecular Formula C24H29NO4
Exact Mass 395.209658 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID HLzlsgyl6HF
Name Ethaverine MS2
CAS Registry Number 486-47-5
Comments F: ITMS + c ESI d w Full ms2 396.34
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Formula C24H29NO4
InChI InChI=1S/C24H29NO4/c1-5-26-21-10-9-17(14-22(21)27-6-2)13-20-19-16-24(29-8-4)23(28-7-3)15-18(19)11-12-25-20/h9-12,14-16H,5-8,13H2,1-4H3
InChIKey ZOWYFYXTIWQBEP-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES CCOC=1C=C2C(=CC1OCC)C(=NC=C2)CC=1C=C(C(=CC1)OCC)OCC
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS