| SpectraBase Spectrum ID |
Lx0TpCr4iW5 |
| Name |
3H-Indol-3-one, 5,7-dichloro-2-(5,7-dichloro-4-methyl-3-oxobenzo[B]thien-2(3H)-ylidene)-1,2-dihydro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
428.895160441 u |
| Formula |
C17H7Cl4NO2S |
| InChI |
InChI=1S/C17H7Cl4NO2S/c1-5-8(19)4-10(21)16-11(5)15(24)17(25-16)13-14(23)7-2-6(18)3-9(20)12(7)22-13/h2-4,22H,1H3/b17-13- |
| InChIKey |
SQBSCTTZMDCQHC-LGMDPLHJSA-N |
| Molecular Weight |
431.120 g/mol |
| SMILES |
N1\C(C(C=2C1=C(C=C(C2)Cl)Cl)=O)=C\1C(C2=C(S1)C(=CC(=C2C)Cl)Cl)=O |
| Spectrum/Structure Validation Score (Raman) |
0.706636 |
![3H-Indol-3-one, 5,7-dichloro-2-(5,7-dichloro-4-methyl-3-oxobenzo[b]thien-2(3H)-ylidene)-1,2-dihydro-](/api/spectrum/Lx0TpCr4iW5/structure.png?h=300&w=458 "3H-Indol-3-one, 5,7-dichloro-2-(5,7-dichloro-4-methyl-3-oxobenzo[b]thien-2(3H)-ylidene)-1,2-dihydro-")
