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Tricyclo[3.3.1.1(3,7)]decanone, 4-phenyl-, (1.alpha.,3.beta.,4.alpha.,5.alpha.,7.beta.)-
SpectraBase Compound ID 827ZvwdhlQ0
InChI InChI=1S/C16H18O/c17-16-13-7-10-6-12(9-13)15(14(16)8-10)11-4-2-1-3-5-11/h1-5,10,12-15H,6-9H2/t10-,12-,13-,14-,15-/m1/s1
InChIKey NVTKJTZXEBFHQP-DIAXPKBXSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gTBxkzlW0S
Name Tricyclo[3.3.1.1(3,7)]decanone, 4-phenyl-, (1.alpha.,3.beta.,4.alpha.,5.alpha.,7.beta.)-
Alternate Name(s) (1R,3R,4R,5R,7R)-4-phenyltricyclo[3.3.1.1(3,7)]decan-2-one 4a-phenyladamantan-2-one
CAS Registry Number 77172-07-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c17-16-13-7-10-6-12(9-13)15(14(16)8-10)11-4-2-1-3-5-11/h1-5,10,12-15H,6-9H2/t10-,12-,13-,14-,15-/m1/s1
InChIKey NVTKJTZXEBFHQP-DIAXPKBXSA-N
Molecular Weight 226.319 g/mol
SMILES [C@@]12(C([C@]3([H])C[C@](C2)(C[C@@]([C@]1(c1ccccc1)[H])(C3)[H])[H])=O)[H]
SPLASH splash10-004i-7090000000-f3087d83c39fe2ddd084
Source of Spectrum F-40-201-0
Wiley ID 1228210