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1,1':2',1''-Tercyclohexane
SpectraBase Compound ID 4hR8sDg6JPU
InChI InChI=1S/C18H32/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16/h15-18H,1-14H2
InChIKey JSVILEFZXZLOES-UHFFFAOYSA-N
Mol Weight 248.5 g/mol
Molecular Formula C18H32
Exact Mass 248.250401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9MfOFJqr1ZN
Name 1,1':2',1''-Tercyclohexane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.250401030 u
Formula C18H32
InChI InChI=1S/C18H32/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16/h15-18H,1-14H2
InChIKey JSVILEFZXZLOES-UHFFFAOYSA-N
Molecular Weight 248.454 g/mol
SMILES C1(C(CCCC1)C1CCCCC1)C1CCCCC1