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Benzamide, 4-bromo-N-(2-butyl)-N-hexadecyl-
SpectraBase Compound ID 2lEsCjDVTlo
InChI InChI=1S/C27H46BrNO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-29(24(3)5-2)27(30)25-19-21-26(28)22-20-25/h19-22,24H,4-18,23H2,1-3H3
InChIKey SQKDATMQXCAADS-UHFFFAOYSA-N
Mol Weight 480.6 g/mol
Molecular Formula C27H46BrNO
Exact Mass 479.276278 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2sgJpGvRjJU
Name Benzamide, 4-bromo-N-(2-butyl)-N-hexadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 479.276278104 u
Formula C27H46BrNO
InChI InChI=1S/C27H46BrNO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-29(24(3)5-2)27(30)25-19-21-26(28)22-20-25/h19-22,24H,4-18,23H2,1-3H3
InChIKey SQKDATMQXCAADS-UHFFFAOYSA-N
Molecular Weight 480.575 g/mol
SMILES C(=O)(N(CCCCCCCCCCCCCCCC)C(CC)C)C=1C=CC(=CC1)Br