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rac-(2-Methyl-5-(6-methylhept-5-en-2-yl)phenyl)methanamine
SpectraBase Compound ID 4sqbrsxzlSj
InChI InChI=1S/C16H25N/c1-12(2)6-5-7-13(3)15-9-8-14(4)16(10-15)11-17/h6,8-10,13H,5,7,11,17H2,1-4H3/t13-/m1/s1
InChIKey ZKFVGVHBAUCDID-CYBMUJFWSA-N
Mol Weight 231.38 g/mol
Molecular Formula C16H25N
Exact Mass 231.1987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1n0pAPFJs4F
Name rac-(2-Methyl-5-(6-methylhept-5-en-2-yl)phenyl)methanamine
Appearance Slightly yellow viscous oil
Carrier Gas Hydrogen
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Formula C16H25N
GC Oven Program Oven temp 300 oC
InChI InChI=1S/C16H25N/c1-12(2)6-5-7-13(3)15-9-8-14(4)16(10-15)11-17/h6,8-10,13H,5,7,11,17H2,1-4H3/t13-/m1/s1
InChIKey ZKFVGVHBAUCDID-CYBMUJFWSA-N
Instrument Name Agilent GC6890-HP 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200058
Molecular Weight 231.383 g/mol
Quality 363
SMILES NCC1=CC(=CC=C1C)[C@](C)(CCC=C(C)C)[H]
SPLASH splash10-00rx-4910000000-06770a2c57daa68835cd
Source of Spectrum K1-2022-SM14-rac-2c (DOI: 10.1002/ejoc.202200058)
Thin-Layer Chromatography 0.3 (SiO2, cHex/EtOAc/MeOH, 3:3:1 + 0.5 vol% NEt3)
Wiley ID 1898711