SpectraBase Spectrum ID |
Bu03fD9vAB7 |
Name |
Traxoprodil -H2O |
CAS Registry Number |
134234-12-1 |
Classification |
Psychotropic drug |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
309.172878983 u |
Formula |
C20H23NO2 |
InChI |
InChI=1S/C20H23NO2/c1-16(15-17-7-9-19(22)10-8-17)21-13-11-20(23,12-14-21)18-5-3-2-4-6-18/h2-10,15,22-23H,11-14H2,1H3/b16-15+ |
InChIKey |
XVEAOUARVCERJG-FOCLMDBBSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
309.409 g/mol |
SMILES |
c1cc(\C=C/(C)N2CCC(CC2)(c2ccccc2)O)ccc1O |
SPLASH |
splash10-0zfr-7970000000-47d76fdbaa39ed8dccca |
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. |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_9706 |