| SpectraBase Compound ID | IBThSeSE5ae |
|---|---|
| InChI | InChI=1S/C10H8Cl3NOS/c11-10(12,13)9(14)6-7(15)3-4-8-2-1-5-16-8/h1-6H,14H2/b4-3+,9-6- |
| InChIKey | QCISWTCNBIFBRP-KXIWCOCFSA-N |
| Mol Weight | 296.6 g/mol |
| Molecular Formula | C10H8Cl3NOS |
| Exact Mass | 294.939218 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8fgBmjxp8r4 |
|---|---|
| Name | (1E,4Z)-5-Amino-6,6,6-trichloro-1-(2-thienyl)-1,4-hexadien-3-one |
| CAS Registry Number | 350680-27-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H8Cl3NOS |
| InChI | InChI=1S/C10H8Cl3NOS/c11-10(12,13)9(14)6-7(15)3-4-8-2-1-5-16-8/h1-6H,14H2/b4-3+,9-6- |
| InChIKey | QCISWTCNBIFBRP-KXIWCOCFSA-N |
| Molecular Weight | 296.599 g/mol |
| SMILES | N\C(C(Cl)(Cl)Cl)=C/C(\C=C\c1sccc1)=O |
| SPLASH | splash10-002s-9840000000-bdbe84bcd4fdb95c742f |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | (1E,4Z)-5-amino-6,6,6-trichloro-1-(2-thienyl)hexa-1,4-dien-3-one (1E,4Z)-5-amino-6,6,6-trichloro-1-thiophen-2-yl-3-hexa-1,4-dienone (1E,4Z)-5-amino-6,6,6-trichloro-1-thiophen-2-ylhexa-1,4-dien-3-one (1E,4Z)-5-azanyl-6,6,6-tris(chloranyl)-1-thiophen-2-yl-hexa-1,4-dien-3-one Hexa-1,4-dien-3-one, 5-amino-6,6,6-trichloro-1-(2-thienyl)- |
| Wiley ID | 1430538 |