Dataset
infrared absorption spectroscopy (IR)
Chemical Info
InChI | InChI=1S/C12H9Cl3O6/c1-19-10(16)4-7(13)5(11(17)20-2)9(15)6(8(4)14)12(18)21-3/h1-3H3 |
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SMILES | COC(=O)c1c(Cl)c(C(=O)OC)c(c(c1Cl)C(=O)OC)Cl |
InChI Key | YDTPGQNDWOTCLE-UHFFFAOYSA-N |
Molecular Formula | C12H9Cl3O6 |
Exact Mass | 355.555 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/YDTPGQNDWOTCLE-UHFFFAOYSA-N/CHMO0000630 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/YDTPGQNDWOTCLE-UHFFFAOYSA-N/CHMO0000630 |
Version | |
Author | Lisa Schmidt |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T02:03:01.835231 |
MetadataModified | 2024-09-08T02:03:01.835236 |
MetadataPublished | 2023-12-05 |
Field | Value |
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Measurement Technique | infrared absorption spectroscopy |
Measurement Variables |