| SpectraBase Spectrum ID |
2p87bwrLT9s |
| Name |
Cinnamoylglycine methyl ester |
| CAS Registry Number |
40778-04-9 |
| Classification |
Pharmaceutical drug, nootropic |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
219.089543280 u |
| Formula |
C12H13NO3 |
| InChI |
InChI=1S/C12H13NO3/c1-16-12(15)9-13-11(14)8-7-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H,13,14)/b8-7- |
| InChIKey |
XFAGPDNLMRNSRO-FPLPWBNLSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
219.240 g/mol |
| Nominal Mass |
219 u |
| Quality |
882 |
| Retention Index |
1685 |
| SMILES |
C(NCC(OC)=O)(\C=C/C1=CC=CC=C1)=O |
| SPLASH |
splash10-0f89-3900000000-0b29bfeb5dbd3cfa9e43 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl (((2Z)-3-phenylprop-2-enoyl)amino)acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000713 |
