| SpectraBase Spectrum ID |
BwZ4Xkzg23t |
| Name |
(3RS,4SR)-and(3RS,4RS)-3-Hydroxy-6-methyl-4-(phenylthio)heptanonitrile |
| Alternate Name(s) |
3-Hydroxy-6-methyl-4-(phenylsulfanyl)heptanenitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H19NOS |
| InChI |
InChI=1S/C14H19NOS/c1-11(2)10-14(13(16)8-9-15)17-12-6-4-3-5-7-12/h3-7,11,13-14,16H,8,10H2,1-2H3 |
| InChIKey |
YVUXPWKGACREMI-UHFFFAOYSA-N |
| Molecular Weight |
249.372 g/mol |
| SMILES |
OC(C(Sc1ccccc1)CC(C)C)CC#N |
| SPLASH |
splash10-00di-0900000000-a3bcbc582bde831af84f |
| Source of Spectrum |
KC-1993-1652-50 |
| Wiley ID |
778304 |
