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Glycine, 2-cyclohexyl-N-isobutoxycarbonyl-, tetradecyl ester

View entire compound with spectra: 1 NMR

Glycine, 2-cyclohexyl-N-isobutoxycarbonyl-, tetradecyl ester
SpectraBase Compound ID JPTpsDwEb9j
InChI InChI=1S/C27H51NO4/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-31-26(29)25(24-19-16-15-17-20-24)28-27(30)32-22-23(2)3/h23-25H,4-22H2,1-3H3,(H,28,30)
InChIKey OCXXENOTXHQMJM-UHFFFAOYSA-N
Mol Weight 453.7 g/mol
Molecular Formula C27H51NO4
Exact Mass 453.381809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IP6sbZHb0ov
Name Glycine, 2-cyclohexyl-N-isobutoxycarbonyl-, tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 453.381809122 u
Formula C27H51NO4
InChI InChI=1S/C27H51NO4/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-31-26(29)25(24-19-16-15-17-20-24)28-27(30)32-22-23(2)3/h23-25H,4-22H2,1-3H3,(H,28,30)
InChIKey OCXXENOTXHQMJM-UHFFFAOYSA-N
Molecular Weight 453.708 g/mol
SMILES C1CC(CCC1)C(NC(=O)OCC(C)C)C(OCCCCCCCCCCCCCC)=O