| SpectraBase Spectrum ID |
9slXEbCUO6b |
| Name |
(3RS,4SR)-2,6,6-Trimethyl-4-phenylsulfanylheptane-1,3-diol |
| Alternate Name(s) |
(3S,4R)-2,6,6-Trimethyl-4-phenylsulfanylheptane-1,3-diol
2,6,6-trimethyl-4-(phenylsulfanyl)-1,3-heptanediol
(3S,4R)-2,2,6-trimethyl-4-phenylsulfanylheptane-1,3-diol
(3S,4R)-2,2,6-trimethyl-4-phenylsulfanyl-heptane-1,3-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H26O2S |
| InChI |
InChI=1S/C16H26O2S/c1-12(2)10-14(15(18)16(3,4)11-17)19-13-8-6-5-7-9-13/h5-9,12,14-15,17-18H,10-11H2,1-4H3/t14-,15-/m1/s1 |
| InChIKey |
DQNWFTKWDDGJGI-HUUCEWRRSA-N |
| Molecular Weight |
282.442 g/mol |
| SMILES |
OCC([C@@]([C@](Sc1ccccc1)(CC(C)C)[H])(O)[H])(C)C |
| SPLASH |
splash10-03lr-0900000000-9976f3e44166be255683 |
| Source of Spectrum |
KC-0-545-54 |
| Wiley ID |
829993 |
