| SpectraBase Spectrum ID |
CfvHQqTOrOA |
| Name |
Dimethyl (2S)-2-{(tert-butyloxy)-N-[(tert-butoxy)carbonyl]carbonylamino}hexanedioate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.204966954 u |
| Formula |
C18H31NO8 |
| InChI |
InChI=1S/C18H31NO8/c1-17(2,3)26-15(22)19(16(23)27-18(4,5)6)12(14(21)25-8)10-9-11-13(20)24-7/h12H,9-11H2,1-8H3/t12-/m0/s1 |
| InChIKey |
WLOANMRNZGBCGV-LBPRGKRZSA-N |
| Molecular Weight |
389.445 g/mol |
| SMILES |
C(N(C(OC(C)(C)C)=O)[C@](C(=O)OC)(CCCC(=O)OC)[H])(OC(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958423 |
![Dimethyl (2S)-2-{(tert-butyloxy)-N-[(tert-butoxy)carbonyl]carbonylamino}hexanedioate](/api/spectrum/CfvHQqTOrOA/structure.png?h=300&w=458 "Dimethyl (2S)-2-{(tert-butyloxy)-N-[(tert-butoxy)carbonyl]carbonylamino}hexanedioate")
