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1-(2,2,2-trifluoroethoxyl)-3-(N-acetylpiperidin-2-yl)methylcarbamoyl)-4-acetoxybenzene
SpectraBase Compound ID BJh87GAX4fd
InChI InChI=1S/C19H23F3N2O5/c1-12(25)24-8-4-3-5-14(24)10-23-18(27)16-9-15(28-11-19(20,21)22)6-7-17(16)29-13(2)26/h6-7,9,14H,3-5,8,10-11H2,1-2H3,(H,23,27)
InChIKey WHNUTSXQILIQHI-UHFFFAOYSA-N
Mol Weight 416.4 g/mol
Molecular Formula C19H23F3N2O5
Exact Mass 416.155906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdZZoY9fLgJ
Name 1-(2,2,2-trifluoroethoxyl)-3-(N-acetylpiperidin-2-yl)methylcarbamoyl)-4-acetoxybenzene
Alternate Name(s) 2-({[(1-acetyl-2-piperidinyl)methyl]amino}carbonyl)-4-(2,2,2-trifluoroethoxy)phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23F3N2O5
InChI InChI=1S/C19H23F3N2O5/c1-12(25)24-8-4-3-5-14(24)10-23-18(27)16-9-15(28-11-19(20,21)22)6-7-17(16)29-13(2)26/h6-7,9,14H,3-5,8,10-11H2,1-2H3,(H,23,27)
InChIKey WHNUTSXQILIQHI-UHFFFAOYSA-N
Molecular Weight 416.397 g/mol
SMILES N(C(c1c(OC(=O)C)ccc(c1)OCC(F)(F)F)=O)CC1N(C(=O)C)CCCC1
SPLASH splash10-003r-9510000000-cce5f262298d8b808a3d
Source of Spectrum CJ-1992-0-0
Wiley ID 1376214