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Benzamide, 2-bromo-N-butyl-N-tetradecyl-
SpectraBase Compound ID 4Yi47VN8Q7E
InChI InChI=1S/C25H42BrNO/c1-3-5-7-8-9-10-11-12-13-14-15-18-22-27(21-6-4-2)25(28)23-19-16-17-20-24(23)26/h16-17,19-20H,3-15,18,21-22H2,1-2H3
InChIKey OQHVJPCVSIVCDQ-UHFFFAOYSA-N
Mol Weight 452.5 g/mol
Molecular Formula C25H42BrNO
Exact Mass 451.244978 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6nbYEGkA1Td
Name Benzamide, 2-bromo-N-butyl-N-tetradecyl-
Comments Computed using HOSE algorithm
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Exact Mass 451.244977975 u
Formula C25H42BrNO
InChI InChI=1S/C25H42BrNO/c1-3-5-7-8-9-10-11-12-13-14-15-18-22-27(21-6-4-2)25(28)23-19-16-17-20-24(23)26/h16-17,19-20H,3-15,18,21-22H2,1-2H3
InChIKey OQHVJPCVSIVCDQ-UHFFFAOYSA-N
Molecular Weight 452.521 g/mol
SMILES C(=O)(N(CCCC)CCCCCCCCCCCCCC)C=1C=CC=CC1Br