Dataset
4-(1-Hydroxyethyl)benzoic acid isopropylester.1d
Chemical Info
InChI | InChI=1S/C12H16O3/c1-8(2)15-12(14)11-6-4-10(5-7-11)9(3)13/h4-9,13H,1-3H3 |
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SMILES | CC(C)OC(=O)C1=CC=C(C(C)O)C=C1 |
InChI Key | XLJDPAYYVIVVLW-UHFFFAOYSA-N |
Molecular Formula | C12H16O3 |
Exact Mass | 208.250 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.57992/nmrxiv.p9.s53.d200 |
License URL | https://creativecommons.org/licenses/by/4.0/legalcode |
Source | https://nmrxiv.org/D200 |
Version | |
Author | |
Maintainer | |
Language | english |
MetadataCreated | 2024-04-22T16:32:33.427995 |
MetadataModified | 2024-09-17T12:52:20.766506 |
MetadataPublished |
Field | Value |
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Measurement Technique | 1H nuclear magnetic resonance spectroscopy |
Measurement Variables |
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Data-Source Molecule ID | Data-Source |
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85373555 | PubChem |
J3.294.213J | Nikkaji |
The data in this table is sourced from UniChem at EBI. |