| SpectraBase Spectrum ID |
Aa4CCSHmSOk |
| Name |
Ethaverine-M isomer-2 ME |
| Classification |
Antispasmotic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
381.194008349 u |
| Formula |
C23H27NO4 |
| InChI |
InChI=1S/C23H27NO4/c1-5-26-20-9-8-16(13-22(20)27-6-2)12-19-18-15-23(28-7-3)21(25-4)14-17(18)10-11-24-19/h8-11,13-15H,5-7,12H2,1-4H3 |
| InChIKey |
PTGHBSIGMHZHJG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
381.472 g/mol |
| SMILES |
c1c(OC)c(cc2c(Cc3ccc(c(c3)OCC)OCC)nccc12)OCC |
| SPLASH |
splash10-0f89-0129000000-74ad8dc08717d64eb2c3 |
| 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 |
| Synonyms |
Ethaverine-M (O-deethyl-) isomer-2 ME |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_3716 |
