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(2R,3S)-2-(4-Chlorophenyl)-3-[(E)-styryl]cyclopropane-1,1,2-tricarbonitrile
SpectraBase Compound ID 6yksUQhXxzF
InChI InChI=1S/C20H12ClN3/c21-17-9-7-16(8-10-17)20(14-24)18(19(20,12-22)13-23)11-6-15-4-2-1-3-5-15/h1-11,18H/b11-6+/t18-,20-/m1/s1
InChIKey LJVJKTVTFYGGIA-OOEGTRTCSA-N
Mol Weight 329.79 g/mol
Molecular Formula C20H12ClN3
Exact Mass 329.071975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 95IiXxgp5nN
Name (2R,3S)-2-(4-Chlorophenyl)-3-[(E)-styryl]cyclopropane-1,1,2-tricarbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C20H12ClN3
InChI InChI=1S/C20H12ClN3/c21-17-9-7-16(8-10-17)20(14-24)18(19(20,12-22)13-23)11-6-15-4-2-1-3-5-15/h1-11,18H/b11-6+/t18-,20-/m1/s1
InChIKey LJVJKTVTFYGGIA-OOEGTRTCSA-N
Molecular Weight 329.790 g/mol
SMILES C1([C@](C#N)(c2ccc(cc2)Cl)[C@@]1(\C=C\c1ccccc1)[H])(C#N)C#N
SPLASH splash10-004l-0049000000-95add0c4401774164db0
Source of Spectrum U1-2010-1983-3j
Wiley ID 1663534