Dataset
infrared absorption spectroscopy (IR)
Chemical Info
InChI | InChI=1S/C11H12O4/c1-7-4-10(14-8(2)12)6-11(5-7)15-9(3)13/h4-6H,1-3H3 |
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SMILES | CC(=O)Oc1cc(OC(=O)C)cc(c1)C |
InChI Key | KDOYCAADBINREP-UHFFFAOYSA-N |
Molecular Formula | C11H12O4 |
Exact Mass | 208.211 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/KDOYCAADBINREP-UHFFFAOYSA-N/CHMO0000630.1 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/KDOYCAADBINREP-UHFFFAOYSA-N/CHMO0000630.1 |
Version | |
Author | Simone Gräßle |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T02:14:40.846429 |
MetadataModified | 2024-09-08T02:14:40.846440 |
MetadataPublished | 2024-01-19 |
Field | Value |
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Measurement Technique | infrared absorption spectroscopy |
Measurement Variables |