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Benzamide, 2-bromo-N-benzyl-N-hexadecyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Benzamide, 2-bromo-N-benzyl-N-hexadecyl-
SpectraBase Compound ID COMMRjDq6Kh
InChI InChI=1S/C30H44BrNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-25-32(26-27-21-16-15-17-22-27)30(33)28-23-18-19-24-29(28)31/h15-19,21-24H,2-14,20,25-26H2,1H3
InChIKey VLHZIFOWKOAHJP-UHFFFAOYSA-N
Mol Weight 514.6 g/mol
Molecular Formula C30H44BrNO
Exact Mass 513.260628 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HptzZkWfL2a
Name Benzamide, 2-bromo-N-benzyl-N-hexadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 513.260628040 u
Formula C30H44BrNO
InChI InChI=1S/C30H44BrNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-25-32(26-27-21-16-15-17-22-27)30(33)28-23-18-19-24-29(28)31/h15-19,21-24H,2-14,20,25-26H2,1H3
InChIKey VLHZIFOWKOAHJP-UHFFFAOYSA-N
Molecular Weight 514.592 g/mol
SMILES C(N(CCCCCCCCCCCCCCCC)CC1=CC=CC=C1)(=O)C=1C(Br)=CC=CC1