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2-chloro-5-cyclohexylpyrimidine
SpectraBase Compound ID BDS5Ch9KFKg
InChI InChI=1S/C10H13ClN2/c11-10-12-6-9(7-13-10)8-4-2-1-3-5-8/h6-8H,1-5H2
InChIKey QEJXRJUEPYEFTC-UHFFFAOYSA-N
Mol Weight 196.68 g/mol
Molecular Formula C10H13ClN2
Exact Mass 196.076726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDd8J7gQ1q
Name 2-chloro-5-cyclohexylpyrimidine
Appearance Off-white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.076726127 u
Formula C10H13ClN2
InChI InChI=1S/C10H13ClN2/c11-10-12-6-9(7-13-10)8-4-2-1-3-5-8/h6-8H,1-5H2
InChIKey QEJXRJUEPYEFTC-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201701691
Molecular Weight 196.681 g/mol
Quality 258
Reported Formula C10H13ClN2
SMILES C1(Cl)=NC=C(C=N1)C1CCCCC1
SPLASH splash10-0007-0900000000-32890c5bcae95ade1f61
Source of Spectrum ACI-56-SM14-4j (DOI: 10.1002/anie.201701691)
Thin-Layer Chromatography 0.70 (Hexane/EtOAc, 1:1)
Wiley ID 1895992