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Cyclohexanone, 2-isopropenyl-5-methyl-2-methyl-D3-, (2S,5R)-
SpectraBase Compound ID IQKrwGiAxzb
InChI InChI=1S/C11H18O/c1-8(2)11(4)6-5-9(3)7-10(11)12/h9H,1,5-7H2,2-4H3/t9-,11+/m1/s1/i4D3
InChIKey MIZDPYBNDZVDLH-QYFKGWEWSA-N
Mol Weight 169.28 g/mol
Molecular Formula C11H15D3O
Exact Mass 169.154595 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NSYVo2MCYw
Name Cyclohexanone, 2-isopropenyl-5-methyl-2-methyl-D3-, (2S,5R)-
Alternate Name(s) (-)2-Isopropenyl-2-methyl-D3-5-methylcyclohexanone
CAS Registry Number 22565-94-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15D3O
InChI InChI=1S/C11H18O/c1-8(2)11(4)6-5-9(3)7-10(11)12/h9H,1,5-7H2,2-4H3/t9-,11+/m1/s1/i4D3
InChIKey MIZDPYBNDZVDLH-QYFKGWEWSA-N
Molecular Weight 169.282 g/mol
SMILES [C@]1(C(C[C@@](CC1)(C)[H])=O)(C(=C)C)C([D])([D])[D]
SPLASH splash10-002f-9300000000-7787c6c069f8640ac897
Source of Spectrum EP-4039-0-0
Wiley ID 1163223