SpectraBase Spectrum ID |
I2JEq9ACENK |
Name |
1H-2-naphtho[2,3-c]thiapyran-5,10-dione-2,2-dioxide |
Comments |
Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 854741 moved to the Legacy library |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H8O4S |
InChI |
InChI=1S/C13H8O4S/c14-12-8-3-1-2-4-9(8)13(15)11-7-18(16,17)6-5-10(11)12/h1-6H,7H2 |
InChIKey |
ZDGKGMOCDMQYFS-UHFFFAOYSA-N |
Molecular Weight |
260.263 g/mol |
SMILES |
C12=C(C(c3ccccc3C2=O)=O)C=CS(C1)(=O)=O |
SPLASH |
splash10-03e9-0390000000-01ebb6c2a0d292b73548 |
Source of Spectrum |
AT-41-758-2 |
Wiley ID |
1821153 |