| SpectraBase Spectrum ID |
FSGskVCwISg |
| Name |
(Phenylmethyl) N-[cyano-[(2S,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]carbamate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.116486302 u |
| Formula |
C15H18N2O6 |
| InChI |
InChI=1S/C15H18N2O6/c16-6-10(14-13(20)12(19)11(7-18)23-14)17-15(21)22-8-9-4-2-1-3-5-9/h1-5,10-14,18-20H,7-8H2,(H,17,21)/t10?,11-,12-,13-,14+/m1/s1 |
| InChIKey |
AGRDWIMRDRTCLW-HTGUOZFMSA-N |
| Molecular Weight |
322.317 g/mol |
| SMILES |
[C@@]1(O[C@](CO)([C@]([C@]1(O)[H])(O)[H])[H])(C(NC(=O)OCC=1C=CC=CC1)C#N)[H] |
![(phenylmethyl) N-[cyano-[(2S,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]carbamate](/api/spectrum/FSGskVCwISg/structure.png?h=300&w=458 "(phenylmethyl) N-[cyano-[(2S,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]carbamate")
