| SpectraBase Spectrum ID |
DzJkVmOFrn4 |
| Name |
3-methyl-1-(4-phenylsulfanyltetrahydrothiopyran-4-yl)butane-1,3-diol |
| Alternate Name(s) |
3-methyl-1-(4-phenylsulfanylthian-4-yl)butane-1,3-diol
3-methyl-1-[4-(phenylthio)-4-thianyl]butane-1,3-diol
3-methyl-1-[4-(phenylthio)tetrahydrothiopyran-4-yl]butane-1,3-diol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H24O2S2 |
| InChI |
InChI=1S/C16H24O2S2/c1-15(2,18)12-14(17)16(8-10-19-11-9-16)20-13-6-4-3-5-7-13/h3-7,14,17-18H,8-12H2,1-2H3 |
| InChIKey |
LHGZYVOAMAJGSW-UHFFFAOYSA-N |
| Molecular Weight |
312.486 g/mol |
| SMILES |
OC(CC(C1(Sc2ccccc2)CCSCC1)O)(C)C |
| SPLASH |
splash10-0006-0091000000-6ba2f20390a16f9be078 |
| Source of Spectrum |
KC-0-1911-37 |
| Wiley ID |
831137 |
