Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C10H11BrO3/c1-3-14-10(13)7-4-6(2)9(11)8(12)5-7/h4-5,12H,3H2,1-2H3 |
---|---|
SMILES | CCOC(=O)c1cc(C)c(c(c1)O)Br |
InChI Key | HJPPCNABHLJUFL-UHFFFAOYSA-N |
Molecular Formula | C10H11BrO3 |
Exact Mass | 259.097 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/HJPPCNABHLJUFL-UHFFFAOYSA-N/CHMO0000596.1 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/HJPPCNABHLJUFL-UHFFFAOYSA-N/CHMO0000596.1 |
Version | |
Author | Simone Gräßle |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2025-02-04T13:26:30.980595 |
MetadataModified | 2025-02-04T13:26:30.980601 |
MetadataPublished | 2025-01-08 |
Related Molecule |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
J2.512.500B | Nikkaji |
ZINC000072233513 | ZINC |
16072027 | PubChem: Thomson Pharma |
SCHEMBL1425675 | SureChEMBL |
11010688 | PubChem |
The data in this table is sourced from UniChem at EBI. |