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1-Hexanone, 2,2,4-trimethyl-1-phenyl-, (S)-
SpectraBase Compound ID FJ1N4tZYnjy
InChI InChI=1S/C15H22O/c1-5-12(2)11-15(3,4)14(16)13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3/t12-/m0/s1
InChIKey GGOGCBHTGCQBEF-LBPRGKRZSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dOkvtAl5Us
Name 1-Hexanone, 2,2,4-trimethyl-1-phenyl-, (S)-
CAS Registry Number 61067-08-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-5-12(2)11-15(3,4)14(16)13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3/t12-/m0/s1
InChIKey GGOGCBHTGCQBEF-LBPRGKRZSA-N
Molecular Weight 218.340 g/mol
SMILES C(C(=O)c1ccccc1)(C[C@](CC)(C)[H])(C)C
SPLASH splash10-0a4i-0900000000-93cb2982acb8560a1c08
Source of Spectrum C-98-6222-0
Synonyms (4S)-2,2,4-trimethyl-1-phenyl-1-hexanone (4S)-2,2,4-trimethyl-1-phenylhexan-1-one
Wiley ID 1218154