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Cyclohexane, (1-hexadecylheptadecyl)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

Cyclohexane, (1-hexadecylheptadecyl)-
SpectraBase Compound ID KZhNsoCyHLW
InChI InChI=1S/C39H78/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-34-38(39-36-32-29-33-37-39)35-31-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h38-39H,3-37H2,1-2H3
InChIKey SUJPBAUMCPFUIW-UHFFFAOYSA-N
Mol Weight 547.1 g/mol
Molecular Formula C39H78
Exact Mass 546.610353 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GbfIeY9AxZL
Name Cyclohexane, (1-hexadecylheptadecyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 546.610352512 u
Formula C39H78
InChI InChI=1S/C39H78/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-34-38(39-36-32-29-33-37-39)35-31-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h38-39H,3-37H2,1-2H3
InChIKey SUJPBAUMCPFUIW-UHFFFAOYSA-N
Molecular Weight 547.053 g/mol
SMILES C(C(CCCCCCCCCCCCCCCC)C1CCCCC1)CCCCCCCCCCCCCCC