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3-(2-(2-Methylallyl)cyclobut-1-en-1-yl)pyridine
SpectraBase Compound ID 5MEF6yTET4W
InChI InChI=1S/C13H15N/c1-10(2)8-11-5-6-13(11)12-4-3-7-14-9-12/h3-4,7,9H,1,5-6,8H2,2H3
InChIKey ARNBBBRGIFTFBH-UHFFFAOYSA-N
Mol Weight 185.27 g/mol
Molecular Formula C13H15N
Exact Mass 185.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXl0AdwZl5o
Name 3-(2-(2-Methylallyl)cyclobut-1-en-1-yl)pyridine
Appearance Orange oil
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Formula C13H15N
InChI InChI=1S/C13H15N/c1-10(2)8-11-5-6-13(11)12-4-3-7-14-9-12/h3-4,7,9H,1,5-6,8H2,2H3
InChIKey ARNBBBRGIFTFBH-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201604585
Molecular Weight 185.270 g/mol
Quality 151
Reported Formula C13H15N
SMILES CC(CC1=C(CC1)C=1C=NC=CC1)=C
SPLASH splash10-00e9-0900000000-ddbe6762158e9c8be1a4
Source of Spectrum QE-23-SM39-21d (DOI: 10.1002/chem.201604585)
Thin-Layer Chromatography 0.2 (hexane/EtOAc, 9:1, UV, KMnO4, PAA)
Wiley ID 1903892