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Ethaverine-M isomer-1 AC
SpectraBase Compound ID DtAA8KIFv07
InChI InChI=1S/C24H27NO5/c1-5-27-22-13-17(8-9-21(22)30-16(4)26)12-20-19-15-24(29-7-3)23(28-6-2)14-18(19)10-11-25-20/h8-11,13-15H,5-7,12H2,1-4H3
InChIKey SUZHUEOLTWHFSV-UHFFFAOYSA-N
Mol Weight 409.48 g/mol
Molecular Formula C24H27NO5
Exact Mass 409.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1K8QjY2MiG
Name Ethaverine-M isomer-2 AC
Classification Antispasmotic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 409.188922968 u
Formula C24H27NO5
InChI InChI=1S/C24H27NO5/c1-5-27-22-13-17(8-9-21(22)30-16(4)26)12-20-19-15-24(29-7-3)23(28-6-2)14-18(19)10-11-25-20/h8-11,13-15H,5-7,12H2,1-4H3
InChIKey SUZHUEOLTWHFSV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 409.482 g/mol
SMILES c1(cc(c(OC(C)=O)cc1)OCC)Cc1c2cc(OCC)c(cc2ccn1)OCC
SPLASH splash10-00kr-0119200000-84c644fda37c046d469e
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
Synonyms Ethaverine-M (O-deethyl-) isomer-2 AC
Technique GC/MS
Wiley ID MMPW6e_3075