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1-(Adamant-1-yl)-2-(pyrid-4-yl)-1-(p-tolyl)-ethane

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

1-(Adamant-1-yl)-2-(pyrid-4-yl)-1-(p-tolyl)-ethane
SpectraBase Compound ID BYo9fXnac6b
InChI InChI=1S/C24H29N/c1-17-2-4-22(5-3-17)23(13-18-6-8-25-9-7-18)24-14-19-10-20(15-24)12-21(11-19)16-24/h2-9,19-21,23H,10-16H2,1H3
InChIKey CGJPYRUOAYYFJF-UHFFFAOYSA-N
Mol Weight 331.5 g/mol
Molecular Formula C24H29N
Exact Mass 331.23 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FJFChnNKEM3
Name 1-(Adamant-1-yl)-2-(pyrid-4-yl)-1-(p-tolyl)-ethane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 331.229999938 u
Formula C24H29N
InChI InChI=1S/C24H29N/c1-17-2-4-22(5-3-17)23(13-18-6-8-25-9-7-18)24-14-19-10-20(15-24)12-21(11-19)16-24/h2-9,19-21,23H,10-16H2,1H3
InChIKey CGJPYRUOAYYFJF-UHFFFAOYSA-N
Molecular Weight 331.503 g/mol
SMILES C1C2CC3CC1CC(C2)(C(CC=1C=CN=CC1)C1=CC=C(C=C1)C)C3