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rac-trans-2-(Cyclohex-1-ene-1-carbonyl)-N-methoxy-N-methylcyclohexane-1-carboxamide
SpectraBase Compound ID KZUmVoaGnlT
InChI InChI=1S/C16H25NO3/c1-17(20-2)16(19)14-11-7-6-10-13(14)15(18)12-8-4-3-5-9-12/h8,13-14H,3-7,9-11H2,1-2H3/t13-,14-/m1/s1
InChIKey AXFAGEFHIDKYIU-ZIAGYGMSSA-N
Mol Weight 279.38 g/mol
Molecular Formula C16H25NO3
Exact Mass 279.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B7kjmhBxM7F
Name rac-trans-2-(Cyclohex-1-ene-1-carbonyl)-N-methoxy-N-methylcyclohexane-1-carboxamide
Appearance Colorless oil
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Formula C16H25NO3
InChI InChI=1S/C16H25NO3/c1-17(20-2)16(19)14-11-7-6-10-13(14)15(18)12-8-4-3-5-9-12/h8,13-14H,3-7,9-11H2,1-2H3/t13-,14-/m1/s1
InChIKey AXFAGEFHIDKYIU-ZIAGYGMSSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901043
Molecular Weight 279.380 g/mol
Quality 181
Reported Formula C16H25NO3
SMILES C1(=CCCCC1)C(=O)[C@]1([C@@](CCCC1)(C(=O)N(OC)C)[H])[H]
SPLASH splash10-066r-4790000000-8535068264b3c7eeab26
Source of Spectrum K1-2019-6259-6 (DOI: 10.1002/ejoc.201901043)
Thin-Layer Chromatography 0.3 (cyclohexane/EtOAc, 2:1)
Wiley ID 1892240