| SpectraBase Spectrum ID |
64IBP91elbq |
| Name |
1,4-Butanediol, 3-methyl-1-phenyl-, [S-(R*,R*)]- |
| Alternate Name(s) |
(1R,3S)- and (1S,3S)-3-methyl-1-phenyl-1,4-butanediols
(1S,3S)-3-methyl-1-phenyl-1,4-butanediol |
| CAS Registry Number |
89968-79-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H16O2 |
| InChI |
InChI=1S/C11H16O2/c1-9(8-12)7-11(13)10-5-3-2-4-6-10/h2-6,9,11-13H,7-8H2,1H3/t9-,11-/m0/s1 |
| InChIKey |
STCQQLBAPJKVAW-ONGXEEELSA-N |
| Molecular Weight |
180.247 g/mol |
| SMILES |
OC[C@](C[C@@](c1ccccc1)(O)[H])(C)[H] |
| SPLASH |
splash10-056r-8900000000-bc21f318d25423b7ed52 |
| Source of Spectrum |
H-67-298-0 |
| Wiley ID |
1176395 |
![1,4-Butanediol, 3-methyl-1-phenyl-, [S-(R*,R*)]-](/api/spectrum/64IBP91elbq/structure.png?h=300&w=458 "1,4-Butanediol, 3-methyl-1-phenyl-, [S-(R*,R*)]-")
