| SpectraBase Spectrum ID |
2PTYPHKGkz |
| Name |
(Z)-7-[(4S,5R)-2,2-Dimethyl-5-methylol-1,3-dioxolan-4-yl]hept-5-enoic acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.162373868 u |
| Formula |
C14H24O5 |
| InChI |
InChI=1S/C14H24O5/c1-14(2)18-11(12(10-15)19-14)8-6-4-5-7-9-13(16)17-3/h4,6,11-12,15H,5,7-10H2,1-3H3/b6-4-/t11-,12+/m0/s1 |
| InChIKey |
AYRIICGYSDPXIM-XEGQIGPUSA-N |
| Molecular Weight |
272.341 g/mol |
| SMILES |
C1(O[C@](CO)([C@@](O1)(C\C=C/CCCC(=O)OC)[H])[H])(C)C |
![(Z)-7-[(4S,5R)-2,2-dimethyl-5-methylol-1,3-dioxolan-4-yl]hept-5-enoic acid methyl ester](/api/spectrum/2PTYPHKGkz/structure.png?h=300&w=458 "(Z)-7-[(4S,5R)-2,2-dimethyl-5-methylol-1,3-dioxolan-4-yl]hept-5-enoic acid methyl ester")
