SpectraBase Spectrum ID |
DmLhhmLNau8 |
Name |
Diprafenone 2AC |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
453.251523226 u |
Formula |
C27H35NO5 |
InChI |
InChI=1S/C27H35NO5/c1-6-27(4,5)28(20(2)29)18-23(33-21(3)30)19-32-26-15-11-10-14-24(26)25(31)17-16-22-12-8-7-9-13-22/h7-15,23H,6,16-19H2,1-5H3 |
InChIKey |
KAOPCWKRYKOIPU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
453.579 g/mol |
Nominal Mass |
453 u |
Quality |
938 |
Retention Index |
3367 |
SMILES |
C(N(CC(COC=1C(C(CCC2=CC=CC=C2)=O)=CC=CC1)OC(=O)C)C(=O)C)(CC)(C)C |
SPLASH |
splash10-0fdo-5915000000-5a0480b13b0727e9e6f1 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(acetyl(2-methylbutan-2-yl)amino)-3-(2-(3-phenylpropanoyl)phenoxy)propan-2-yl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_007897 |