For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Phenyl-2-adamantanone
SpectraBase Compound ID IQqFYVwmkoh
InChI InChI=1S/C16H18O/c17-15-13-7-11-6-12(8-13)10-16(15,9-11)14-4-2-1-3-5-14/h1-5,11-13H,6-10H2/t11-,12+,13-,16+
InChIKey XYQOOBSGDHIYLN-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2zy5fhi7KA3
Name 1-Phenyl-2-adamantanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c17-15-13-7-11-6-12(8-13)10-16(15,9-11)14-4-2-1-3-5-14/h1-5,11-13H,6-10H2/t11-,12+,13-,16+
InChIKey XYQOOBSGDHIYLN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19731060112
Molecular Weight 226.319 g/mol
SMILES [C@]12(C[C@@]3(C[C@](C2)(C[C@](C1=O)(C3)c1ccccc1)[H])[H])[H]
SPLASH splash10-0a6r-4940000000-7e939dbcd1bb56b910d2
Source of Spectrum K-106-89-14
Synonyms (1r,3s,5R,7S)-1-phenyladamantan-2-one
Wiley ID 1793485