SpectraBase Compound ID | 6Mh6ntF3uHB |
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InChI | InChI=1S/C7Cl6O/c8-1-2(9)4(11)6(13)7(14)5(12)3(1)10 |
InChIKey | WGSYUYMYPJFQHE-UHFFFAOYSA-N |
Mol Weight | 312.8 g/mol |
Molecular Formula | C7Cl6O |
Exact Mass | 309.808031 g/mol |
SpectraBase Spectrum ID | 9LoRPXQAN1D |
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Name | hexachloro-2,4,6-cycloheptatrien-1-one |
CAS Registry Number | 21505-24-8 |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7Cl6O |
InChI | InChI=1S/C7Cl6O/c8-1-2(9)4(11)6(13)7(14)5(12)3(1)10 |
InChIKey | WGSYUYMYPJFQHE-UHFFFAOYSA-N |
Molecular Weight | 312.794 g/mol |
SMILES | C1(=C(C(=C(Cl)C(C(=C1Cl)Cl)=O)Cl)Cl)Cl |
SPLASH | splash10-001i-0090000000-1b3af5de086a642aa18e |
Source of Spectrum | K-121-1598-6 |
Synonyms | 2,3,4,5,6,7-hexachloro-2,4,6-cycloheptatrien-1-one 2,3,4,5,6,7-hexachloro-1-cyclohepta-2,4,6-trienone 2,3,4,5,6,7-hexakis(chloranyl)cyclohepta-2,4,6-trien-1-one |
Wiley ID | 1310935 |