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Ethaverine-M isomer-1 2AC
SpectraBase Compound ID Jy1rxhOH1RD
InChI InChI=1S/C24H25NO6/c1-5-28-22-12-17(7-8-21(22)30-15(3)26)11-20-19-14-23(29-6-2)24(31-16(4)27)13-18(19)9-10-25-20/h7-10,12-14H,5-6,11H2,1-4H3
InChIKey UREYZRYAQHKAGP-UHFFFAOYSA-N
Mol Weight 423.47 g/mol
Molecular Formula C24H25NO6
Exact Mass 423.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bv4hrDBOw3E
Name Ethaverine-M isomer-1 2AC
Classification Antispasmotic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 423.168187523 u
Formula C24H25NO6
InChI InChI=1S/C24H25NO6/c1-5-28-22-12-17(7-8-21(22)30-15(3)26)11-20-19-14-23(29-6-2)24(31-16(4)27)13-18(19)9-10-25-20/h7-10,12-14H,5-6,11H2,1-4H3
InChIKey UREYZRYAQHKAGP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 423.465 g/mol
SMILES c1c2ccnc(Cc3cc(OCC)c(cc3)OC(C)=O)c2cc(OCC)c1OC(C)=O
SPLASH splash10-0h3r-0109200000-d622ced76f59a06adb58
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 (bis-deethyl-) isomer-1 2AC
Technique GC/MS
Wiley ID MMPW6e_3668