| SpectraBase Spectrum ID |
E6AAxsqUyF2 |
| Name |
(4S,5R)-(2,2-Dimethoxyethyl)-(5-hydroxymethyl-2,2-dimethyl[1,3]dioxolan-4-ylmethyl)carbamic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.163102142 u |
| Formula |
C13H25NO7 |
| InChI |
InChI=1S/C13H25NO7/c1-13(2)20-9(10(8-15)21-13)6-14(12(16)19-5)7-11(17-3)18-4/h9-11,15H,6-8H2,1-5H3/t9-,10+/m0/s1 |
| InChIKey |
UTEAFVPHVVZHPW-VHSXEESVSA-N |
| Molecular Weight |
307.343 g/mol |
| SMILES |
[C@@]1(OC(C)(C)O[C@@]1(CO)[H])(CN(C(=O)OC)CC(OC)OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.853182 |
![(4S,5R)-(2,2-Dimethoxyethyl)-(5-hydroxymethyl-2,2-dimethyl[1,3]dioxolan-4-ylmethyl)carbamic acid methyl ester](/api/spectrum/E6AAxsqUyF2/structure.png?h=300&w=458 "(4S,5R)-(2,2-Dimethoxyethyl)-(5-hydroxymethyl-2,2-dimethyl[1,3]dioxolan-4-ylmethyl)carbamic acid methyl ester")
