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1-(3-pyridyl)-2-propenyl pivalate
SpectraBase Compound ID 9YByntHGc6X
InChI InChI=1S/C13H17NO2/c1-5-11(10-7-6-8-14-9-10)16-12(15)13(2,3)4/h5-9,11H,1H2,2-4H3
InChIKey IWNPXJWADVYFAB-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hKyC6kB6z
Name 1-(3-pyridyl)-2-propenyl pivalate
Appearance Orange oil
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Exact Mass 219.125928789 u
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-5-11(10-7-6-8-14-9-10)16-12(15)13(2,3)4/h5-9,11H,1H2,2-4H3
InChIKey IWNPXJWADVYFAB-UHFFFAOYSA-N
Instrument Name Agilent 6890N/5975B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201602252
Molecular Weight 219.284 g/mol
Quality 286
Reported Formula C13H17NO2
SMILES C=1C=CN=CC1C(OC(=O)C(C)(C)C)C=C
SPLASH splash10-066r-9600000000-64e61541553eeedfbb37
Source of Spectrum ACI-55-SM5-2'g (DOI: 10.1002/anie.201602252)
Thin-Layer Chromatography 0.18 (hexane/ethyl acetate, 5:1)
Wiley ID 1900958