| SpectraBase Spectrum ID |
2wfviZNssw2 |
| Name |
6-Methyl-1,1-difluoro-3-[(4'-methylphenyl)sulfenyl]hept-5-en-2-yl benzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
390.146507511 u |
| Formula |
C22H24F2O2S |
| InChI |
InChI=1S/C22H24F2O2S/c1-15(2)9-14-19(27-18-12-10-16(3)11-13-18)20(21(23)24)26-22(25)17-7-5-4-6-8-17/h4-13,19-21H,14H2,1-3H3 |
| InChIKey |
BQZKAHBKOWQHHF-UHFFFAOYSA-N |
| Molecular Weight |
390.489 g/mol |
| SMILES |
C(OC(=O)C1=CC=CC=C1)(C(SC=1C=CC(=CC1)C)CC=C(C)C)C(F)F |
![6-Methyl-1,1-difluoro-3-[(4'-methylphenyl)sulfenyl]hept-5-en-2-yl benzoate](/api/spectrum/2wfviZNssw2/structure.png?h=300&w=458 "6-Methyl-1,1-difluoro-3-[(4'-methylphenyl)sulfenyl]hept-5-en-2-yl benzoate")
