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

View entire compound with spectra: 1 NMR

Glycine, 2-cyclohexyl-N-isobutoxycarbonyl-, octyl ester
SpectraBase Compound ID JnJh5L7M5IU
InChI InChI=1S/C21H39NO4/c1-4-5-6-7-8-12-15-25-20(23)19(18-13-10-9-11-14-18)22-21(24)26-16-17(2)3/h17-19H,4-16H2,1-3H3,(H,22,24)
InChIKey MTJYGRLLWIUILT-UHFFFAOYSA-N
Mol Weight 369.5 g/mol
Molecular Formula C21H39NO4
Exact Mass 369.287909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BEWR4HkWV8p
Name Glycine, 2-cyclohexyl-N-isobutoxycarbonyl-, octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 369.287908736 u
Formula C21H39NO4
InChI InChI=1S/C21H39NO4/c1-4-5-6-7-8-12-15-25-20(23)19(18-13-10-9-11-14-18)22-21(24)26-16-17(2)3/h17-19H,4-16H2,1-3H3,(H,22,24)
InChIKey MTJYGRLLWIUILT-UHFFFAOYSA-N
Molecular Weight 369.546 g/mol
SMILES C1CC(CCC1)C(NC(=O)OCC(C)C)C(OCCCCCCCC)=O