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3-(3,5-Dimethylphenyl)adamantanol-1

View entire compound with spectra: 1 NMR

3-(3,5-Dimethylphenyl)adamantanol-1
SpectraBase Compound ID IsS8KFDlvSX
InChI InChI=1S/C18H24O/c1-12-3-13(2)5-16(4-12)17-7-14-6-15(8-17)10-18(19,9-14)11-17/h3-5,14-15,19H,6-11H2,1-2H3/t14-,15+,17+,18-
InChIKey UFEFMZUXKSWKRO-YJEJQGFLSA-N
Mol Weight 256.39 g/mol
Molecular Formula C18H24O
Exact Mass 256.182715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 19K4pAp1EnB
Name 3-(3,5-Dimethylphenyl)adamantanol-1
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.182715392 u
Formula C18H24O
InChI InChI=1S/C18H24O/c1-12-3-13(2)5-16(4-12)17-7-14-6-15(8-17)10-18(19,9-14)11-17/h3-5,14-15,19H,6-11H2,1-2H3/t14-,15+,17+,18-
InChIKey UFEFMZUXKSWKRO-YJEJQGFLSA-N
Molecular Weight 256.389 g/mol
SMILES CC1=CC(=CC(C)=C1)[C@]12C[C@]3(C[C@@](C2)(C[C@](O)(C3)C1)[H])[H]