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2,4-Dichloro-3-iodobenzonitrile
SpectraBase Compound ID KougCHU2rXq
InChI InChI=1S/C7H2Cl2IN/c8-5-2-1-4(3-11)6(9)7(5)10/h1-2H
InChIKey KVONTBRKDLIYNZ-UHFFFAOYSA-N
Mol Weight 297.91 g/mol
Molecular Formula C7H2Cl2IN
Exact Mass 296.860899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTkcKf0KS7d
Name 2,4-Dichloro-3-iodobenzonitrile
Appearance Light yellow solid
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Exact Mass 296.860899468 u
Formula C7H2Cl2IN
InChI InChI=1S/C7H2Cl2IN/c8-5-2-1-4(3-11)6(9)7(5)10/h1-2H
InChIKey KVONTBRKDLIYNZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201508719
Molecular Weight 297.910 g/mol
Quality 986
Reported Formula C7H2Cl2IN
SMILES C1(Cl)=C(C(=C(C=C1)C#N)Cl)I
SPLASH splash10-0abc-9000000000-9cce24e6254d8a70a743
Source of Spectrum ACI-55-SM19-19b (DOI: 10.1002/anie.201508719)
Wiley ID 1895093