Dataset
1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Chemical Info
InChI | InChI=1S/C9H7NO/c11-9-3-1-2-7-4-5-10-6-8(7)9/h1-6,11H |
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SMILES | Oc1cccc2c1cncc2 |
InChI Key | ZIXWTPREILQLAC-UHFFFAOYSA-N |
Molecular Formula | C9H7NO |
Exact Mass | 145.158 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/ZIXWTPREILQLAC-UHFFFAOYSA-N/CHMO0001148 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/ZIXWTPREILQLAC-UHFFFAOYSA-N/CHMO0001148 |
Version | |
Author | Jana Alpin |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2025-02-04T13:29:44.307673 |
MetadataModified | 2025-02-04T13:29:44.307679 |
MetadataPublished | 2025-01-22 |
Field | Value |
---|---|
Measurement Technique | 1H–13C heteronuclear multiple bond coherence |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
CB3957147 | ChemicalBook |
J1.398.041A | Nikkaji |
ZINC000006513210 | ZINC |
7587001 | eMolecules |
SCHEMBL276528 | SureChEMBL |
3482-14-2 | ACToR |
135441711 | PubChem |
The data in this table is sourced from UniChem at EBI. |