| SpectraBase Spectrum ID |
K9mVJWZQUao |
| Name |
2,2-Dimethylpropanoic acid 2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propan-2-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.167459249 u |
| Formula |
C13H24O4 |
| InChI |
InChI=1S/C13H24O4/c1-11(2,3)10(14)17-12(4,5)9-8-15-13(6,7)16-9/h9H,8H2,1-7H3/t9-/m0/s1 |
| InChIKey |
ASMYMLXKZBJCGO-VIFPVBQESA-N |
| Molecular Weight |
244.331 g/mol |
| SMILES |
C(OC([C@]1(OC(C)(C)OC1)[H])(C)C)(C(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893485 |
![2,2-Dimethylpropanoic acid 2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propan-2-yl ester](/api/spectrum/K9mVJWZQUao/structure.png?h=300&w=458 "2,2-Dimethylpropanoic acid 2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propan-2-yl ester")
