Dataset
Idaverine; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
Chemical Information
| InChI | InChI=1S/C24H39N3O3/c1-6-26(19(2)18-20-9-11-22(30-5)12-10-20)15-7-8-23(28)27-16-13-21(14-17-27)24(29)25(3)4/h9-12,19,21H,6-8,13-18H2,1-5H3/t19-/m0/s1 |
|---|---|
| SMILES | CCN(CCCC(=O)N1CCC(CC1)C(=O)N(C)C)[C@@H](C)CC2=CC=C(C=C2)OC |
| InChI Key | FUWZBLSXACKFQX-IBGZPJMESA-N |
| Molecular Formula | C24H39N3O3 |
| Exact Mass | 417.299 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU108504 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2015-09-22 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 100927-13-7 | ACToR |
| 15353357 | PubChem: Thomson Pharma |
| SCHEMBL180957 | SureChEMBL |
| CHEMBL2106340 | ChEMBL |
| U6212R3SLC | FDA SRS |
| 10341921 | PubChem |
| DTXSID80881410 | EPA CompTox Dashboard |
| The data in this table is sourced from UniChem at EBI. | |