| SpectraBase Spectrum ID |
JthYkOTOLJY |
| Name |
3-Methyl-1-[(2'-tetrahydropyran-4'-yl)oxy]-5-{[2"-methyl-(1,3)-dithian-2"-yl]phenyl}-2-butenol |
| Alternate Name(s) |
3-Methyl-1-[2-(tetrahydro-pyran-4-yloxy)-5-(2-methyl-[1,3]dithian-2-yl)phenyl]-but-2-en-1-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O3S2 |
| InChI |
InChI=1S/C21H30O3S2/c1-15(2)13-19(22)18-14-16(21(3)25-11-4-12-26-21)5-6-20(18)24-17-7-9-23-10-8-17/h5-6,13-14,17,19,22H,4,7-12H2,1-3H3 |
| InChIKey |
CDGWWMYHEHQOEO-UHFFFAOYSA-N |
| Molecular Weight |
394.588 g/mol |
| SMILES |
OC(c1cc(C2(SCCCS2)C)ccc1OC1CCOCC1)C=C(C)C |
| SPLASH |
splash10-03di-0009000000-b742575bc74850046f52 |
| Source of Spectrum |
SK-24-1015-4 |
| Wiley ID |
866152 |
![3-Methyl-1-[(2'-tetrahydropyran-4'-yl)oxy]-5-{[2"-methyl-(1,3)-dithian-2"-yl]phenyl}-2-butenol](/api/spectrum/JthYkOTOLJY/structure.png?h=300&w=458 "3-Methyl-1-[(2'-tetrahydropyran-4'-yl)oxy]-5-{[2\"-methyl-(1,3)-dithian-2\"-yl]phenyl}-2-butenol")
