| SpectraBase Spectrum ID |
5wO8p17VLVz |
| Name |
N-Benzyl-4-amino-4-deoxy-2,3-o-isopropylidene-D-erythronolactam |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.120843408 u |
| Formula |
C14H17NO3 |
| InChI |
InChI=1S/C14H17NO3/c1-14(2)17-11-9-15(13(16)12(11)18-14)8-10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3/t11-,12-/m0/s1 |
| InChIKey |
GDIDRTWUVNJULD-RYUDHWBXSA-N |
| Molecular Weight |
247.294 g/mol |
| SMILES |
C(N1C[C@@]2(OC(C)(C)O[C@@]2(C1=O)[H])[H])C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93225 |
