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2-Butanone, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-D5
SpectraBase Compound ID HGECdVq39Tf
InChI InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-9H2,1-4H3/i2D3,7D2
InChIKey QJJDNZGPQDGNDX-RCIWAKOPSA-N
Mol Weight 199.35 g/mol
Molecular Formula C13H17D5O
Exact Mass 199.198449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4K6KQN5SoUQ
Name 2-Butanone, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-D5
Alternate Name(s) .alpha.,.beta.-Dihydro-.beta.-ionone-D5 4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-butanone-D5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17D5O
InChI InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-9H2,1-4H3/i2D3,7D2
InChIKey QJJDNZGPQDGNDX-RCIWAKOPSA-N
Molecular Weight 199.349 g/mol
SMILES C(C(C([D])([D])[D])=O)(CC1=C(CCCC1(C)C)C)([D])[D]
SPLASH splash10-0005-9300000000-1655d33d52a53dc3e97b
Source of Spectrum H-59-57-48
Wiley ID 1191566