SpectraBase Spectrum ID |
DmA4AYKtsxM |
Name |
Doxylamine-M (-C4H11NO,+OH) |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
197.084063977 u |
Formula |
C13H11NO |
InChI |
InChI=1S/C13H11NO/c1-10(13-7-2-3-8-14-13)11-5-4-6-12(15)9-11/h2-9,15H,1H2 |
InChIKey |
MIZUBWSJZFNSSO-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
197.237 g/mol |
Nominal Mass |
197 u |
Quality |
836 |
Retention Index |
1554 |
SMILES |
OC1=CC(C(C2=NC=CC=C2)=C)=CC=C1 |
SPLASH |
splash10-0002-1900000000-2c4552bb3eb1b465571d |
Sample Comments |
Structure uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-(1-(pyridin-2-yl)ethenyl)phenyl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_006245 |