SpectraBase Spectrum ID |
1K8QjY2MiG |
Name |
Ethaverine-M isomer-2 AC |
Classification |
Antispasmotic |
Comments |
Structure comment: Wiggly bond = unknown position of substituent |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
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 |