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Ethaverine-M (HO-) ME
SpectraBase Compound ID 9hlhmm51bJ8
InChI InChI=1S/C25H31NO5/c1-6-28-21-15-18-10-11-26-20(19(18)16-22(21)29-7-2)12-17-13-23(27-5)25(31-9-4)24(14-17)30-8-3/h10-11,13-16H,6-9,12H2,1-5H3
InChIKey NTEJDYOBFRJAAN-UHFFFAOYSA-N
Mol Weight 425.53 g/mol
Molecular Formula C25H31NO5
Exact Mass 425.220223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 467g7slkRys
Name Ethaverine-M (HO-) ME
Classification Antispasmotic
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Exact Mass 425.220223097 u
Formula C25H31NO5
InChI InChI=1S/C25H31NO5/c1-6-28-21-15-18-10-11-26-20(19(18)16-22(21)29-7-2)12-17-13-23(27-5)25(31-9-4)24(14-17)30-8-3/h10-11,13-16H,6-9,12H2,1-5H3
InChIKey NTEJDYOBFRJAAN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 425.525 g/mol
SMILES c1c2ccnc(Cc3cc(c(c(c3)OCC)OCC)OC)c2cc(c1OCC)OCC
SPLASH splash10-002b-2439600000-572537fed357dc8dec88
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: UHYME
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_3713