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Ethyl (2R,3S,6S)-2-methyl-6-propylpiperidine-3-carboxylate
SpectraBase Compound ID CPRDL7gAp9C
InChI InChI=1S/C12H23NO2/c1-4-6-10-7-8-11(9(3)13-10)12(14)15-5-2/h9-11,13H,4-8H2,1-3H3/t9-,10+,11+/m1/s1
InChIKey ULMCQNBDDBKXIO-VWYCJHECSA-N
Mol Weight 213.32 g/mol
Molecular Formula C12H23NO2
Exact Mass 213.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4ATPtSiAln
Name Ethyl (2R,3S,6S)-2-methyl-6-propylpiperidine-3-carboxylate
Appearance Colourless liquid
Carrier Gas Helium (0.7 mL/min)
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Exact Mass 213.172878983 u
Formula C12H23NO2
GC Column HP-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300 oC
InChI InChI=1S/C12H23NO2/c1-4-6-10-7-8-11(9(3)13-10)12(14)15-5-2/h9-11,13H,4-8H2,1-3H3/t9-,10+,11+/m1/s1
InChIKey ULMCQNBDDBKXIO-VWYCJHECSA-N
Inlet Type Split (90:1)
Instrument Name Agilent 7890A GC-5975C
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202300050
Molecular Weight 213.321 g/mol
Quality 291
SMILES N1[C@](CC[C@@]([C@]1(C)[H])(C(=O)OCC)[H])(CCC)[H]
SPLASH splash10-00di-3900000000-cfc285995dc2fb02c648
Source of Spectrum ASC-365-SM15-rel-(2R,3S,6S)-4e (DOI: 10.1002/adsc.202300050)
Thin-Layer Chromatography 0.83 (silica gel 60, MTBE/MeOH/NH4OH, 90:9:1)
Wiley ID 1909668