| SpectraBase Spectrum ID |
2ovYGqilArP |
| Name |
1,4-Naphthalenedione, 2-(2-oxocyclohexyl)-3-(phenylthio)- |
| Alternate Name(s) |
2-(2-oxocyclohexyl)-3-(phenylsulfanyl)naphthoquinone
2-(2-Oxocyclohexyl)-3-phenylthio-1,4-naphthoquinone |
| CAS Registry Number |
129155-38-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H18O3S |
| InChI |
InChI=1S/C22H18O3S/c23-18-13-7-6-12-17(18)19-20(24)15-10-4-5-11-16(15)21(25)22(19)26-14-8-2-1-3-9-14/h1-5,8-11,17H,6-7,12-13H2 |
| InChIKey |
RTWRCCDGMHCVTG-UHFFFAOYSA-N |
| Molecular Weight |
362.443 g/mol |
| SMILES |
C1(=C(C(=O)c2c(C1=O)cccc2)Sc1ccccc1)C1C(=O)CCCC1 |
| SPLASH |
splash10-0w29-0093000000-9dc94423c30717bb1529 |
| Source of Spectrum |
KC-1990-443-3 |
| Wiley ID |
1349776 |
