SpectraBase Spectrum ID |
AFjQR0tRhgQ |
Name |
Mexiletine-M isomer-3 AC |
Classification |
Antiarrhythmic |
Comments |
Structure comment: Wiggly bond = unknown position of substituent |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
236.104858991 u |
Formula |
C13H16O4 |
InChI |
InChI=1S/C13H16O4/c1-8-5-6-12(17-11(4)15)10(3)13(8)16-7-9(2)14/h5-6H,7H2,1-4H3 |
InChIKey |
SFMNJDAORVWNQW-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
236.267 g/mol |
SMILES |
c1(c(OCC(C)=O)c(C)c(OC(C)=O)cc1)C |
SPLASH |
splash10-000i-1900000000-8eb70532d650cfa8344f |
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 |
Mexiletine-M (deamino-oxo-HO-) isomer-3 AC |
Technique |
GC/MS |
Wiley ID |
MMPW6e_3045 |