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(2,4-Dimethylphenyl)(3-fluoropyrazin-2-yl)methanol
SpectraBase Compound ID 6JX97twisjh
InChI InChI=1S/C13H13FN2O/c1-8-3-4-10(9(2)7-8)12(17)11-13(14)16-6-5-15-11/h3-7,12,17H,1-2H3
InChIKey CPDVUYGLFIMXSV-UHFFFAOYSA-N
Mol Weight 232.26 g/mol
Molecular Formula C13H13FN2O
Exact Mass 232.101191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ohKDqG4T3d
Name (2,4-Dimethylphenyl)(3-fluoropyrazin-2-yl)methanol
Appearance Pale yellow oil
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Exact Mass 232.101191209 u
Formula C13H13FN2O
InChI InChI=1S/C13H13FN2O/c1-8-3-4-10(9(2)7-8)12(17)11-13(14)16-6-5-15-11/h3-7,12,17H,1-2H3
InChIKey CPDVUYGLFIMXSV-UHFFFAOYSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.201803961
Molecular Weight 232.258 g/mol
Quality 333
Reported Formula C13H13FN2O
SMILES OC(C1=C(C=C(C)C=C1)C)C1=NC=CN=C1F
SPLASH splash10-01q9-1950000000-7a3a6ea52020358e7e60
Source of Spectrum ACI-57-SM19-4r (DOI: 10.1002/anie.201803961)
Wiley ID 1893243