| SpectraBase Spectrum ID |
H1Kq9kMZDbb |
| Name |
Benzoic acid, 2-(2-hydroxy-1-methylpropyl)-4,6-dimethoxy-, ethyl ester, (R*,S*)-(.+-.)- |
| CAS Registry Number |
110087-15-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22O5 |
| InChI |
InChI=1S/C15H22O5/c1-6-20-15(17)14-12(9(2)10(3)16)7-11(18-4)8-13(14)19-5/h7-10,16H,6H2,1-5H3/t9-,10-/m1/s1 |
| InChIKey |
HABGLGAJTAJPAC-NXEZZACHSA-N |
| Molecular Weight |
282.336 g/mol |
| SMILES |
O[C@@]([C@](c1c(c(cc(OC)c1)OC)C(=O)OCC)(C)[H])(C)[H] |
| SPLASH |
splash10-0006-0940000000-7480b5a8c1a566065ea2 |
| Source of Spectrum |
KC-1986-2107-7 |
| Synonyms |
Ethyl (+)-Threo-2-(2-hydroxy-1-methylpropyl)-4,6-dimethoxybenzoate
Ethyl (+-)-threo-2-(2-hydroxy-1-methylpropyl)-4,6-dimethoxybenzoate
Ethyl 2-[(1S,2R)-2-hydroxy-1-methylpropyl]-4,6-dimethoxybenzoate |
| Wiley ID |
1285799 |
