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4-(1-Methylnonyl)-2-nitrophenol, compound with cyclohexylamine (1:1)

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

4-(1-Methylnonyl)-2-nitrophenol, compound with cyclohexylamine (1:1)
SpectraBase Compound ID 2CijPj7lZ1T
InChI InChI=1S/C16H25NO3.C6H13N/c1-3-4-5-6-7-8-9-13(2)14-10-11-16(18)15(12-14)17(19)20;7-6-4-2-1-3-5-6/h10-13,18H,3-9H2,1-2H3;6H,1-5,7H2
InChIKey OHSNWYQAIWIZPQ-UHFFFAOYSA-N
Mol Weight 378.56 g/mol
Molecular Formula C22H38N2O3
Exact Mass 378.288243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DuicNmCnaKu
Name 4-(1-Methylnonyl)-2-nitrophenol, compound with cyclohexylamine (1:1)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 378.288243089 u
Formula C22H38N2O3
InChI InChI=1S/C16H25NO3.C6H13N/c1-3-4-5-6-7-8-9-13(2)14-10-11-16(18)15(12-14)17(19)20;7-6-4-2-1-3-5-6/h10-13,18H,3-9H2,1-2H3;6H,1-5,7H2
InChIKey OHSNWYQAIWIZPQ-UHFFFAOYSA-N
Molecular Weight 378.557 g/mol
SMILES N(=O)(=O)C=1C=C(C=CC1O)C(CCCCCCCC)C.NC1CCCCC1