| SpectraBase Spectrum ID |
JITjs0tY2Bg |
| Name |
cis-1-Tert-butoxycarbonyl-3,4-tert-butoxycarboxepimino-L-proline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.163436495 u |
| Formula |
C15H24N2O6 |
| InChI |
InChI=1S/C15H24N2O6/c1-14(2,3)22-12(20)16-7-8-9(10(16)11(18)19)17(8)13(21)23-15(4,5)6/h8-10H,7H2,1-6H3,(H,18,19)/t8-,9-,10+,17?/m1/s1 |
| InChIKey |
LCRZOBGVRPRLHD-WTXUAKGWSA-N |
| Molecular Weight |
328.365 g/mol |
| SMILES |
[C@]12(N([C@@]1(CN([C@@]2(C(=O)O)[H])C(OC(C)(C)C)=O)[H])C(OC(C)(C)C)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931138 |
