| SpectraBase Spectrum ID |
G6FF4RYI466 |
| Name |
1-Aminocyclopentanecarboxylic acid, N-((1R)-(-)-menthyloxycarbonyl)-, undecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
465.381809122 u |
| Formula |
C28H51NO4 |
| InChI |
InChI=1S/C28H51NO4/c1-5-6-7-8-9-10-11-12-15-20-32-26(30)28(18-13-14-19-28)29-27(31)33-25-21-23(4)16-17-24(25)22(2)3/h22-25H,5-21H2,1-4H3,(H,29,31) |
| InChIKey |
SYXXTKFSCALITB-UHFFFAOYSA-N |
| Molecular Weight |
465.719 g/mol |
| SMILES |
C1CC(C(OCCCCCCCCCCC)=O)(NC(=O)OC2C(C(C)C)CCC(C)C2)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854351 |
