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2-(pyridin-2-yl)heptan-2-ol
SpectraBase Compound ID 2aWCyF36dZc
InChI InChI=1S/C12H19NO/c1-3-4-6-9-12(2,14)11-8-5-7-10-13-11/h5,7-8,10,14H,3-4,6,9H2,1-2H3
InChIKey MXINOOQGVAZGIX-UHFFFAOYSA-N
Mol Weight 193.29 g/mol
Molecular Formula C12H19NO
Exact Mass 193.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sX3KDvAm4M
Name 2-(pyridin-2-yl)heptan-2-ol
Appearance Colourless oil
Carrier Gas Nitrogen
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Exact Mass 193.146664235 u
Formula C12H19NO
InChI InChI=1S/C12H19NO/c1-3-4-6-9-12(2,14)11-8-5-7-10-13-11/h5,7-8,10,14H,3-4,6,9H2,1-2H3
InChIKey MXINOOQGVAZGIX-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201709553
Molecular Weight 193.290 g/mol
Quality 135
Reported Formula C12H19NO
SMILES OC(C1=NC=CC=C1)(CCCCC)C
SPLASH splash10-00di-1900000000-b3af4c6e70540cc52f26
Source of Spectrum ACI-56-SM32-13a (DOI: 10.1002/anie.201709553)
Thin-Layer Chromatography 0.17 (SiO2, i-hexane/EtOAc, 93:7)
Wiley ID 1896742