Dataset
FURFURYLAMINE
Chemical Info
InChI | InChI=1S/C5H7NO/c6-4-5-2-1-3-7-5/h1-3H,4,6H2 |
---|---|
SMILES | NCc(c1)occ1 |
InChI Key | DDRPCXLAQZKBJP-UHFFFAOYSA-N |
Molecular Formula | C5H7NO |
Exact Mass | 97.053 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-nc-sa/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP007325 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T15:55:36.307577 |
MetadataModified | 2024-01-11T15:55:36.480080 |
MetadataPublished | 2016-01-19 |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
J2.084B | Nikkaji |
SCHEMBL43101 | SureChEMBL |
ZOGQIY | CCDC |
ZINC000001681227 | ZINC |
CHEMBL3561633 | ChEMBL |
86GAN59F7R | FDA SRS |
DTXSID6052295 | EPA CompTox Dashboard |
CB0364366 | ChemicalBook |
50195324 | BindingDB |
154284 | Brenda |
110080 | Brenda |
513823 | eMolecules |
15898087 | PubChem: Thomson Pharma |
617-89-0 | ACToR |
3438 | PubChem |
MCULE-8280847881 | Mcule |
The data in this table is sourced from UniChem at EBI. |