SpectraBase Spectrum ID |
KZC0DWNo4O0 |
Name |
Cyclopentanecarboxylic acid, 2-amino-, ethyl ester, (1R,2S)- |
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/c1-2-11-8(10)6-4-3-5-7(6)9/h6-7H,2-5,9H2,1H3/t6-,7+/m1/s1 |
InChIKey |
AGCJYTRMZBPEEO-RQJHMYQMSA-N |
Molecular Weight |
157.213 g/mol |
SMILES |
[C@]1([C@](CCC1)(N)[H])(C(=O)OCC)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.849519 |