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Ethaverine-M (HO-) AC
SpectraBase Compound ID 3Nzcv6WB5aB
InChI InChI=1S/C26H31NO6/c1-6-29-22-15-19-10-11-27-21(20(19)16-23(22)30-7-2)12-18-13-24(31-8-3)26(32-9-4)25(14-18)33-17(5)28/h10-11,13-16H,6-9,12H2,1-5H3
InChIKey BUNZMNAHOKUPML-UHFFFAOYSA-N
Mol Weight 453.54 g/mol
Molecular Formula C26H31NO6
Exact Mass 453.215138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uemLEfIZ1L
Name Ethaverine-M (HO-) AC
Classification Antispasmotic
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Exact Mass 453.215137716 u
Formula C26H31NO6
InChI InChI=1S/C26H31NO6/c1-6-29-22-15-19-10-11-27-21(20(19)16-23(22)30-7-2)12-18-13-24(31-8-3)26(32-9-4)25(14-18)33-17(5)28/h10-11,13-16H,6-9,12H2,1-5H3
InChIKey BUNZMNAHOKUPML-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 453.535 g/mol
SMILES c1c2ccnc(Cc3cc(OCC)c(c(c3)OC(C)=O)OCC)c2cc(OCC)c1OCC
SPLASH splash10-000x-0029300000-dc25301df79fcbcdd630
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.
Sample Preparation Procedure Detected: UHYAC
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_3670