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(E)-N-(2-(4-Methyldihydrofuran-3(2H)-ylidene)-2-phenylethyl)prop-2-en-1-amine
SpectraBase Compound ID 5nDBQUlSGtX
InChI InChI=1S/C16H21NO/c1-3-9-17-10-15(14-7-5-4-6-8-14)16-12-18-11-13(16)2/h3-8,13,17H,1,9-12H2,2H3/b16-15+
InChIKey KNKCATROKQGAOF-FOCLMDBBSA-N
Mol Weight 243.35 g/mol
Molecular Formula C16H21NO
Exact Mass 243.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38RHRyk2Ukc
Name (E)-N-(2-(4-Methyldihydrofuran-3(2H)-ylidene)-2-phenylethyl)prop-2-en-1-amine
Appearance Colorless oil
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Exact Mass 243.162314299 u
Formula C16H21NO
InChI InChI=1S/C16H21NO/c1-3-9-17-10-15(14-7-5-4-6-8-14)16-12-18-11-13(16)2/h3-8,13,17H,1,9-12H2,2H3/b16-15+
InChIKey KNKCATROKQGAOF-FOCLMDBBSA-N
Instrument Name JEOL JMS-700 MStation or JMS-Q1000TD TLC-MS
Ionization Type EI
Literature Reference DOI 10.1002/asia.202201241
Molecular Weight 243.350 g/mol
Optical Rotation [a]D33 = +22.7 (c = 1.00, CHCl3)
Quality 288
Reported Formula C16H21NO
SMILES N(C\C(=C/1C(C)COC1)C1=CC=CC=C1)CC=C
SPLASH splash10-0adu-3900000000-29c3afe131f6f6524a21
Sample Comments 98% ee
Source of Spectrum CAJ-18-SM16-4b (DOI: 10.1002/asia.202201241)
Thin-Layer Chromatography 0.23 (n-hexane/AcOEt, 1:1)
Wiley ID 1901138