| SpectraBase Spectrum ID |
LHQfS3q1AG1 |
| Name |
6-Heptenoic acid, 5-(hydroxymethyl)-2,6-dimethyl-, methyl ester, [S-(R*,S*)]- |
| CAS Registry Number |
119614-74-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H20O3 |
| InChI |
InChI=1S/C11H20O3/c1-4-5-10(8-12)7-6-9(2)11(13)14-3/h4,9-10,12H,1,5-8H2,2-3H3/t9-,10+/m0/s1 |
| InChIKey |
NMVNXCZGLDCNKF-VHSXEESVSA-N |
| Molecular Weight |
200.278 g/mol |
| SMILES |
OC[C@](CC=C)(CC[C@@](C(=O)OC)(C)[H])[H] |
| SPLASH |
splash10-000i-9300000000-652888c3277d6d92161a |
| Source of Spectrum |
F-44-478-6 |
| Synonyms |
(+)-(2S,5S) Methyl 6-hydroxy-2-methyl-5-(2-propenyl)hexanoate
Methyl (2S,5S)-5-(hydroxymethyl)-2-methyl-7-octenoate |
| Wiley ID |
1197725 |
![6-Heptenoic acid, 5-(hydroxymethyl)-2,6-dimethyl-, methyl ester, [S-(R*,S*)]-](/api/spectrum/LHQfS3q1AG1/structure.png?h=300&w=458 "6-Heptenoic acid, 5-(hydroxymethyl)-2,6-dimethyl-, methyl ester, [S-(R*,S*)]-")
