| SpectraBase Spectrum ID |
2n8lpWdwwDI |
| Name |
Methyl atropate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
162.068079560 u |
| Formula |
C10H10O2 |
| InChI |
InChI=1S/C10H10O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3 |
| InChIKey |
GQTXKEVAUZYHGE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
162.188 g/mol |
| Nominal Mass |
162 u |
| Quality |
962 |
| Retention Index |
1179 |
| SMILES |
C1(C(C(OC)=O)=C)=CC=CC=C1 |
| SPLASH |
splash10-0udi-3900000000-19e6f074c925c4e3aba6 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-Phenyl-acrylic acid methyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022595 |
