SpectraBase Spectrum ID |
2jaPw7fSbSp |
Name |
4-Pentenoic acid, 3-hydroxy-2,4-dimethyl-, methyl ester, (R*,S*)-(.+-.)- |
CAS Registry Number |
83588-18-5 |
Comments |
Removed - unrepairable contamination (CH2Cl2) |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C8H14O3 |
InChI |
InChI=1S/C8H14O3/c1-5(2)7(9)6(3)8(10)11-4/h6-7,9H,1H2,2-4H3/t6-,7-/m0/s1 |
InChIKey |
KXKXNCOMNMEEBL-BQBZGAKWSA-N |
Molecular Weight |
158.197 g/mol |
SMILES |
O[C@]([C@@](C(=O)OC)(C)[H])(C(=C)C)[H] |
SPLASH |
splash10-000i-9000000000-297a5a32f593d33e3436 |
Source of Spectrum |
C-108-4611-29 |
Synonyms |
(+-)-(2RS,3RS)-methyl 3-hydroxy-2,4-dimethylprop-4-enoate
methyl (2S,3R)-3-hydroxy-2,4-dimethyl-4-pentenoate |
Wiley ID |
1155226 |