| SpectraBase Spectrum ID |
2B7OlKCOx9X |
| Name |
Cyclopentanecarboxylic acid, 3-amino-, N-methyl-, methyl ester, (1S,3R)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
157.110278725 u |
| Formula |
C8H15NO2 |
| InChI |
InChI=1S/C8H15NO2/c1-9-7-4-3-6(5-7)8(10)11-2/h6-7,9H,3-5H2,1-2H3/t6-,7+/m0/s1 |
| InChIKey |
FYKQCEKTPDPCIP-NKWVEPMBSA-N |
| Molecular Weight |
157.213 g/mol |
| SMILES |
[C@@]1(NC)(C[C@](CC1)(C(=O)OC)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913353 |
