| SpectraBase Spectrum ID |
8j9efrFcwK4 |
| Name |
Ethyl 3-{5'-[(t-butyl)sulfanyl]-2'-oxo-2H-(1)-benzopyran-6'-yl}prop-2-enoate |
| Alternate Name(s) |
ethyl (2E)-3-[5-(tert-butylsulfanyl)-2-oxo-2H-chromen-6-yl]-2-propenoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20O4S |
| InChI |
InChI=1S/C18H20O4S/c1-5-21-15(19)10-7-12-6-9-14-13(8-11-16(20)22-14)17(12)23-18(2,3)4/h6-11H,5H2,1-4H3/b10-7+ |
| InChIKey |
OXSSHWNBDUHGIQ-JXMROGBWSA-N |
| Molecular Weight |
332.414 g/mol |
| SMILES |
c12c(SC(C)(C)C)c(\C=C\C(=O)OCC)ccc2OC(=O)C=C1 |
| SPLASH |
splash10-0a4i-9000000000-807f6717dc216a1c3c20 |
| Source of Spectrum |
H-85-550-22 |
| Wiley ID |
1524110 |
![Ethyl 3-{5'-[(t-butyl)sulfanyl]-2'-oxo-2H-(1)-benzopyran-6'-yl}prop-2-enoate](/api/spectrum/8j9efrFcwK4/structure.png?h=300&w=458 "Ethyl 3-{5'-[(t-butyl)sulfanyl]-2'-oxo-2H-(1)-benzopyran-6'-yl}prop-2-enoate")
