| SpectraBase Spectrum ID |
HpWbrnMdmqX |
| Name |
1-Aminocyclopentanecarboxylic acid, N-((1R)-(-)-menthyloxycarbonyl)-, decyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
451.366159058 u |
| Formula |
C27H49NO4 |
| InChI |
InChI=1S/C27H49NO4/c1-5-6-7-8-9-10-11-14-19-31-25(29)27(17-12-13-18-27)28-26(30)32-24-20-22(4)15-16-23(24)21(2)3/h21-24H,5-20H2,1-4H3,(H,28,30) |
| InChIKey |
GNJKKYVXOLBUPV-UHFFFAOYSA-N |
| Molecular Weight |
451.692 g/mol |
| SMILES |
C1CC(C(OCCCCCCCCCC)=O)(NC(=O)OC2C(C(C)C)CCC(C)C2)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.843882 |
