| SpectraBase Spectrum ID |
LCE45SsEmTa |
| Name |
(2S)-1-(4-Benzoxy-3-methoxy-benzoyl)pyrrolidine-2-carboxylic acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.157622840 u |
| Formula |
C21H23NO5 |
| InChI |
InChI=1S/C21H23NO5/c1-25-19-13-16(20(23)22-12-6-9-17(22)21(24)26-2)10-11-18(19)27-14-15-7-4-3-5-8-15/h3-5,7-8,10-11,13,17H,6,9,12,14H2,1-2H3/t17-/m0/s1 |
| InChIKey |
BFDYMHGIDAVGAS-KRWDZBQOSA-N |
| Molecular Weight |
369.417 g/mol |
| SMILES |
C(N1[C@](C(=O)OC)(CCC1)[H])(C1=CC(OC)=C(C=C1)OCC=1C=CC=CC1)=O |
