| SpectraBase Spectrum ID |
JGJvq7R22Vs |
| Name |
Proline methyl ester TFA |
| CAS Registry Number |
715-58-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
225.061277672 u |
| Formula |
C8H10F3NO3 |
| InChI |
InChI=1S/C8H10F3NO3/c1-15-6(13)5-3-2-4-12(5)7(14)8(9,10)11/h5H,2-4H2,1H3 |
| InChIKey |
SZHIHLKFIRSJER-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
225.167 g/mol |
| Nominal Mass |
225 u |
| Quality |
994 |
| Retention Index |
1640 |
| SMILES |
C(N1C(C(OC)=O)CCC1)(C(F)(F)F)=O |
| SPLASH |
splash10-014i-4900000000-32cbcb50bcebd29aec17 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl 1-(trifluoroacetyl)pyrrolidine-2-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030803 |
