| SpectraBase Spectrum ID |
JftPJEWxghz |
| Name |
6-Aminocaproic acid, N-neopentyloxycarbonyl-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
273.194008349 u |
| Formula |
C14H27NO4 |
| InChI |
InChI=1S/C14H27NO4/c1-5-18-12(16)9-7-6-8-10-15-13(17)19-11-14(2,3)4/h5-11H2,1-4H3,(H,15,17) |
| InChIKey |
JBGYGWGZLMNQIR-UHFFFAOYSA-N |
| SMILES |
C(COC(NCCCCCC(OCC)=O)=O)(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.987543 |
