| SpectraBase Spectrum ID |
GeJY87QbB0i |
| Name |
(3S,5R)-5-(N-Benzyloxycarbonylaminomethyl)-3-(tert-butoxycarbonylamino)-.delta.-butyrolactone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
364.163436495 u |
| Formula |
C18H24N2O6 |
| InChI |
InChI=1S/C18H24N2O6/c1-18(2,3)26-17(23)20-13-9-14(25-16(13)22)19-10-15(21)24-11-12-7-5-4-6-8-12/h4-8,13-14,19H,9-11H2,1-3H3,(H,20,23)/t13-,14+/m0/s1 |
| InChIKey |
QTFSMWBCNIYZAV-UONOGXRCSA-N |
| Molecular Weight |
364.398 g/mol |
| SMILES |
C1(O[C@@](NCC(=O)OCC2=CC=CC=C2)(C[C@@]1(NC(OC(C)(C)C)=O)[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927665 |
