| SpectraBase Spectrum ID |
EsDEMCxldZZ |
| Name |
Benzenemethanol, .alpha.-[1-[(4-methylphenyl)sulfinyl]-2-propenyl]-2-nitro-, [.alpha.R*[S*(R*)]]- |
| CAS Registry Number |
87481-30-9 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17NO4S |
| InChI |
InChI=1S/C17H17NO4S/c1-3-16(23(22)13-10-8-12(2)9-11-13)17(19)14-6-4-5-7-15(14)18(20)21/h3-11,16-17,19H,1H2,2H3 |
| InChIKey |
HUXYLOKBVQTKSN-UHFFFAOYSA-N |
| Molecular Weight |
331.386 g/mol |
| SMILES |
OC(C(S(c1ccc(cc1)C)=O)C=C)c1c(N(=O)=O)cccc1 |
| SPLASH |
splash10-0f6x-6900000000-43db3c5c14df734052e1 |
| Source of Spectrum |
B-36-1053-0 |
| Synonyms |
1-(o-nitrophenyl)-2-(p-methylbenzenesulfinyl)but-3-en-1-ol
2-[(4-methylphenyl)sulfinyl]-1-(2-nitrophenyl)-3-buten-1-ol |
| Wiley ID |
1328618 |
![Benzenemethanol, .alpha.-[1-[(4-methylphenyl)sulfinyl]-2-propenyl]-2-nitro-, [.alpha.R*[S*(R*)]]-](/api/spectrum/EsDEMCxldZZ/structure.png?h=300&w=458 "Benzenemethanol, .alpha.-[1-[(4-methylphenyl)sulfinyl]-2-propenyl]-2-nitro-, [.alpha.R*[S*(R*)]]-")
