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Carbamic acid, [4-(trifluoromethyl)benzoyl]-, 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethyl ester
SpectraBase Compound ID 6edq6fYGi91
InChI InChI=1S/C21H19ClF6N4O3/c22-16-11-15(21(26,27)28)12-29-17(16)32-7-5-31(6-8-32)9-10-35-19(34)30-18(33)13-1-3-14(4-2-13)20(23,24)25/h1-4,11-12H,5-10H2,(H,30,33,34)
InChIKey ALMOZOHAXNZZSW-UHFFFAOYSA-N
Mol Weight 524.85 g/mol
Molecular Formula C21H19ClF6N4O3
Exact Mass 524.104987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BveZQ2c7WWC
Name Carbamic acid, [4-(trifluoromethyl)benzoyl]-, 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethyl ester
Alternate Name(s) N-[oxo-[4-(trifluoromethyl)phenyl]methyl]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-(trifluoromethyl)benzoyl]carbamate 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethyl N-[4-(trifluoromethyl)benzoyl]carbamate 2-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl N-[4-(trifluoromethyl)phenyl]carbonylcarbamate
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Formula C21H19ClF6N4O3
InChI InChI=1S/C21H19ClF6N4O3/c22-16-11-15(21(26,27)28)12-29-17(16)32-7-5-31(6-8-32)9-10-35-19(34)30-18(33)13-1-3-14(4-2-13)20(23,24)25/h1-4,11-12H,5-10H2,(H,30,33,34)
InChIKey ALMOZOHAXNZZSW-UHFFFAOYSA-N
Molecular Weight 524.851 g/mol
SMILES N(C(OCCN1CCN(CC1)c1ncc(cc1Cl)C(F)(F)F)=O)C(=O)c1ccc(cc1)C(F)(F)F
SPLASH splash10-006t-9530000000-4f4e8709cbd99d43330c
Source of Spectrum IY-1-4692-0
Wiley ID 1654903