| SpectraBase Spectrum ID |
JHSWVojqc2y |
| Name |
Phentolamine 3AC |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
407.184506293 u |
| Formula |
C23H25N3O4 |
| InChI |
InChI=1S/C23H25N3O4/c1-16-8-10-20(11-9-16)26(21-6-5-7-22(14-21)30-19(4)29)15-23-24(17(2)27)12-13-25(23)18(3)28/h5-14,23H,15H2,1-4H3 |
| InChIKey |
FUUTYPKHVUQGRY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
407.470 g/mol |
| Nominal Mass |
407 u |
| Quality |
925 |
| Retention Index |
3218 |
| SMILES |
C=1(N(CC2N(C=CN2C(=O)C)C(=O)C)C=2C=CC(=CC2)C)C=C(C=CC1)OC(=O)C |
| SPLASH |
splash10-0a4i-1489700000-2d739997358b7f6ebb34 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(((1,3-diacetyl-2,3-dihydro-1H-imidazol-2-yl)methyl)(4-methylphenyl)amino)phenyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_003562 |
