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(2S,3S)-2-Methyl-3-phenethyl-cyclobutanone
SpectraBase Compound ID Hm6FiWoZyvR
InChI InChI=1S/C13H16O/c1-10-12(9-13(10)14)8-7-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t10-,12-/m0/s1
InChIKey VUFIWRHNRFQTTD-JQWIXIFHSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AkxTxz0H5k3
Name (2S,3S)-2-Methyl-3-phenethyl-cyclobutanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O
InChI InChI=1S/C13H16O/c1-10-12(9-13(10)14)8-7-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t10-,12-/m0/s1
InChIKey VUFIWRHNRFQTTD-JQWIXIFHSA-N
Molecular Weight 188.270 g/mol
SMILES C1(C[C@@]([C@@]1(C)[H])(CCc1ccccc1)[H])=O
SPLASH splash10-0006-9300000000-4e1a9e29ad2f6854293f
Source of Spectrum F5-7-3517-8c/2
Synonyms (2S,3S)-2-methyl-3-(2-phenylethyl)-1-cyclobutanone (2S,3S)-2-methyl-3-(2-phenylethyl)cyclobutanone
Wiley ID 1696703