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5-Dichloromethyl-3-(4-chlorophenyl)-1-(2-hydroxyethyl)-2-pyrazoline
SpectraBase Compound ID Jh80edHBDMC
InChI InChI=1S/C12H13Cl3N2O/c13-9-3-1-8(2-4-9)10-7-11(12(14)15)17(16-10)5-6-18/h1-4,11-12,18H,5-7H2
InChIKey AIRUMQRUMUQBBH-UHFFFAOYSA-N
Mol Weight 307.61 g/mol
Molecular Formula C12H13Cl3N2O
Exact Mass 306.009346 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjncZLauPGX
Name 5-Dichloromethyl-3-(4-chlorophenyl)-1-(2-hydroxyethyl)-2-pyrazoline
Appearance Yellow oil
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Exact Mass 306.009346146 u
Formula C12H13Cl3N2O
InChI InChI=1S/C12H13Cl3N2O/c13-9-3-1-8(2-4-9)10-7-11(12(14)15)17(16-10)5-6-18/h1-4,11-12,18H,5-7H2
InChIKey AIRUMQRUMUQBBH-UHFFFAOYSA-N
Instrument Name Thermoquest trace
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4594
Molecular Weight 307.608 g/mol
Quality 436
SMILES OCCN1N=C(CC1C(Cl)Cl)C1=CC=C(C=C1)Cl
SPLASH splash10-00b9-0492000000-d28e1197ac4f4c485915
Source of Spectrum Y-60-411-7c (DOI: 10.1002/jhet.4594)
Wiley ID 1892548