| SpectraBase Spectrum ID |
JEgdszBkq6S |
| Name |
Bunazosin 2AC |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
457.232519113 u |
| Formula |
C23H31N5O5 |
| InChI |
InChI=1S/C23H31N5O5/c1-6-8-21(31)26-9-7-10-27(12-11-26)23-24-18-14-20(33-5)19(32-4)13-17(18)22(25-23)28(15(2)29)16(3)30/h13-14H,6-12H2,1-5H3 |
| InChIKey |
PXRVHBDGZJFAOD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
457.531 g/mol |
| Nominal Mass |
457 u |
| Quality |
936 |
| Retention Index |
3691 |
| SMILES |
C=1(C=2C(N=C(N3CCN(C(CCC)=O)CCC3)N1)=CC(=C(C2)OC)OC)N(C(=O)C)C(=O)C |
| SPLASH |
splash10-007k-0193000000-e1f6f06c8b971de07ed1 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Bunazocine 2AC
N-acetyl-N-(2-(4-butanoyl-1,4-diazepan-1-yl)-6,7-dimethoxyquinazolin-4-yl)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009238 |
