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Carbonic acid, monoamide, N-octadecyl-, benzyl ester

View entire compound with spectra: 1 NMR

Carbonic acid, monoamide, N-octadecyl-, benzyl ester
SpectraBase Compound ID DrzwIrvW53R
InChI InChI=1S/C26H45NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27-26(28)29-24-25-21-18-17-19-22-25/h17-19,21-22H,2-16,20,23-24H2,1H3,(H,27,28)
InChIKey ZOCZVSUQWOHKCI-UHFFFAOYSA-N
Mol Weight 403.7 g/mol
Molecular Formula C26H45NO2
Exact Mass 403.34503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3XoIsHHha7
Name Carbonic acid, monoamide, N-octadecyl-, benzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 403.345029691 u
Formula C26H45NO2
InChI InChI=1S/C26H45NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27-26(28)29-24-25-21-18-17-19-22-25/h17-19,21-22H,2-16,20,23-24H2,1H3,(H,27,28)
InChIKey ZOCZVSUQWOHKCI-UHFFFAOYSA-N
Molecular Weight 403.651 g/mol
SMILES C(OCC=1C=CC=CC1)(=O)NCCCCCCCCCCCCCCCCCC