Dataset
high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
Chemical Information
| InChI | InChI=1S/C11H13N3/c1-14(2)10-6-7-13-11-8(10)4-3-5-9(11)12/h3-7H,12H2,1-2H3 |
|---|---|
| SMILES | CN(c1ccnc2c1cccc2N)C |
| InChI Key | MCYXBNUZMIJOFB-UHFFFAOYSA-N |
| Molecular Formula | C11H13N3 |
| Exact Mass | 187.241 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/MCYXBNUZMIJOFB-UHFFFAOYSA-N/CHMO0002541 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/MCYXBNUZMIJOFB-UHFFFAOYSA-N/CHMO0002541 |
| Version | |
| Author | Alexander Hoffmann |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2022-02-18 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | high-resolution electrospray ionisation time-of-flight mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 83059958 | PubChem |
| The data in this table is sourced from UniChem at EBI. | |