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3-CYCLOPROPYL-5-TRICHLOROMETHYL-4,5-DIHYDRO-1H-1-PYRAZOLE-METHYLESTER
SpectraBase Compound ID 798Ond9cScg
InChI InChI=1S/C9H11Cl3N2O3/c1-17-7(15)14-8(16,9(10,11)12)4-6(13-14)5-2-3-5/h5,16H,2-4H2,1H3
InChIKey PSAJHNAZSANBAI-UHFFFAOYSA-N
Mol Weight 301.56 g/mol
Molecular Formula C9H11Cl3N2O3
Exact Mass 299.983525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5bqlRvlCky2
Name Methyl 5-(trichloromethyl)-5-hydroxy-3-cyclopropyl-4,5-dihydro-1H-pyrazole-1-carboxylate
Alternate Name(s) methyl 3-cyclopropyl-5-hydroxy-5-(trichloromethyl)-4,5-dihydro-1H-pyrazole-1-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C9H11Cl3N2O3
InChI InChI=1S/C9H11Cl3N2O3/c1-17-7(15)14-8(16,9(10,11)12)4-6(13-14)5-2-3-5/h5,16H,2-4H2,1H3
InChIKey PSAJHNAZSANBAI-UHFFFAOYSA-N
Molecular Weight 301.557 g/mol
SMILES OC1(N(N=C(C1)C1CC1)C(=O)OC)C(Cl)(Cl)Cl
SPLASH splash10-0f89-0900000000-b614d156ae6753d731cd
Source of Spectrum OL-17-410-2
Wiley ID 1611990