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N-(2-[2,5-Dimethoxy-4-(2,2,2-trifluoroethyl)phenyl]ethyl)-3-methoxybenzamide
SpectraBase Compound ID LCjau2bcaBK
InChI InChI=1S/C20H22F3NO4/c1-26-16-6-4-5-14(9-16)19(25)24-8-7-13-10-18(28-3)15(11-17(13)27-2)12-20(21,22)23/h4-6,9-11H,7-8,12H2,1-3H3,(H,24,25)
InChIKey KURIEOOBFLRREJ-UHFFFAOYSA-N
Mol Weight 397.39 g/mol
Molecular Formula C20H22F3NO4
Exact Mass 397.150093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmttLyRIJQ8
Name N-(2-[2,5-Dimethoxy-4-(2,2,2-trifluoroethyl)phenyl]ethyl)-3-methoxybenzamide
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 397.150092677 u
Formula C20H22F3NO4
InChI InChI=1S/C20H22F3NO4/c1-26-16-6-4-5-14(9-16)19(25)24-8-7-13-10-18(28-3)15(11-17(13)27-2)12-20(21,22)23/h4-6,9-11H,7-8,12H2,1-3H3,(H,24,25)
InChIKey KURIEOOBFLRREJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 397.394 g/mol
Nominal Mass 397 u
Quality 993
Retention Index 2634
SMILES C1(=C(C=C(C(=C1)OC)CCNC(C=1C=C(C=CC1)OC)=O)OC)CC(F)(F)F
SPLASH splash10-0002-2591000000-a74eac4ad10f068a4c53
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(2-(2,5-dimethoxy-4-(2,2,2-trifluoroethyl)phenyl)ethyl)-3-methoxybenzamide
Technique GC/MS
Wiley ID DD2024_022615