| SpectraBase Spectrum ID |
8vBBWGVdl04 |
| Name |
1,4-Naphthalenedione, 2-bromo-3-(ethylthio)- |
| Alternate Name(s) |
1,4-Naphthoquinone, 2-bromo-3-(ethylthio)-
2-bromo-3-(ethylsulfanyl)naphthoquinone
2-Bromo-3-(ethylthio)-1,4-naphthoquinone |
| CAS Registry Number |
92025-40-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H9BrO2S |
| InChI |
InChI=1S/C12H9BrO2S/c1-2-16-12-9(13)10(14)7-5-3-4-6-8(7)11(12)15/h3-6H,2H2,1H3 |
| InChIKey |
UOGSNTQCCKVHGB-UHFFFAOYSA-N |
| Molecular Weight |
297.166 g/mol |
| SMILES |
C1(=C(C(=O)c2c(C1=O)cccc2)Br)SCC |
| SPLASH |
splash10-0002-0090000000-e36f2b66bb2da9e4c1c0 |
| Source of Spectrum |
KC-1990-445-11 |
| Wiley ID |
1298634 |
