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Carbamic acid, (4-fluorobenzoyl)-, 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethyl ester
SpectraBase Compound ID Ca889MWr2OB
InChI InChI=1S/C20H19ClF4N4O3/c21-16-11-14(20(23,24)25)12-26-17(16)29-7-5-28(6-8-29)9-10-32-19(31)27-18(30)13-1-3-15(22)4-2-13/h1-4,11-12H,5-10H2,(H,27,30,31)
InChIKey VWBMDHBQIIIUOO-UHFFFAOYSA-N
Mol Weight 474.84 g/mol
Molecular Formula C20H19ClF4N4O3
Exact Mass 474.108181 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EUP8haQz17i
Name Carbamic acid, (4-fluorobenzoyl)-, 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethyl ester
Alternate Name(s) N-[(4-fluorophenyl)-oxomethyl]carbamic acid 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethyl ester 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl N-(4-fluorobenzoyl)carbamate 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethyl N-(4-fluorobenzoyl)carbamate 2-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl N-(4-fluorophenyl)carbonylcarbamate
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Formula C20H19ClF4N4O3
InChI InChI=1S/C20H19ClF4N4O3/c21-16-11-14(20(23,24)25)12-26-17(16)29-7-5-28(6-8-29)9-10-32-19(31)27-18(30)13-1-3-15(22)4-2-13/h1-4,11-12H,5-10H2,(H,27,30,31)
InChIKey VWBMDHBQIIIUOO-UHFFFAOYSA-N
Molecular Weight 474.844 g/mol
SMILES N(C(OCCN1CCN(CC1)c1c(cc(C(F)(F)F)cn1)Cl)=O)C(=O)c1ccc(cc1)F
SPLASH splash10-00dm-9420000000-5f4a42d2b43a73fabbd0
Source of Spectrum IY-1-4684-3
Wiley ID 1654826