SpectraBase Spectrum ID |
Cmcz0JddtQS |
Name |
6,11-Dihydro-7,10-dimethoxy-12H-benzo[B]thioxanthen-6,11-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
338.061280101 u |
Formula |
C19H14O4S |
InChI |
InChI=1S/C19H14O4S/c1-22-12-7-8-13(23-2)16-15(12)17(20)11-9-10-5-3-4-6-14(10)24-19(11)18(16)21/h3-8H,9H2,1-2H3 |
InChIKey |
AREALRBKOZTNHN-UHFFFAOYSA-N |
Molecular Weight |
338.377 g/mol |
SMILES |
C1C=2C(C=3C(C(C2SC=2C=CC=CC12)=O)=C(C=CC3OC)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912372 |