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(E)-3-(3,4-Dimethylphenyl)-2-fluoroacrylonitrile
SpectraBase Compound ID LpgsAyq2Vvs
InChI InChI=1S/C11H10FN/c1-8-3-4-10(5-9(8)2)6-11(12)7-13/h3-6H,1-2H3/b11-6+
InChIKey KPHVENYJEINXJF-IZZDOVSWSA-N
Mol Weight 175.21 g/mol
Molecular Formula C11H10FN
Exact Mass 175.079727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 82guROqhyRx
Name (E)-3-(3,4-Dimethylphenyl)-2-fluoroacrylonitrile
Appearance Light yellow liquid
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Formula C11H10FN
InChI InChI=1S/C11H10FN/c1-8-3-4-10(5-9(8)2)6-11(12)7-13/h3-6H,1-2H3/b11-6+
InChIKey KPHVENYJEINXJF-IZZDOVSWSA-N
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201601483
Molecular Weight 175.206 g/mol
Quality 979
Reported Formula C11H10FN
SMILES C1(\C=C/(F)C#N)=CC=C(C(=C1)C)C
SPLASH splash10-01t9-0900000000-c952b90c7682ad10f15d
Source of Spectrum QE-22-SM39-(E)-3l (DOI: 10.1002/chem.201601483)
Wiley ID 1904924