| SpectraBase Spectrum ID |
1gfbd8Z9pw |
| Name |
Moxaverine-M -H2O isomer-1 AC |
| Classification |
Antispasmotic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
333.136493473 u |
| Formula |
C21H19NO3 |
| InChI |
InChI=1S/C21H19NO3/c1-4-17-11-16-12-21(25-14(2)23)20(24-3)13-18(16)19(22-17)10-15-8-6-5-7-9-15/h4-9,11-13H,1,10H2,2-3H3 |
| InChIKey |
AMOZEGZYDMHXHB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
333.387 g/mol |
| SMILES |
c1c(cccc1)Cc1nc(C=C)cc2c1cc(c(c2)OC(C)=O)OC |
| SPLASH |
splash10-004j-1192000000-5f035d6d067346bf6dc7 |
| 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 |
Moxaverine-M (O-demethyl-HO-ethyl-) -H2O isomer-1 AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_3221 |
