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3-cyclohexyl-2,3-dideuterio-2-methyl-propionic acid ethyl ester
SpectraBase Compound ID 4INFextIP6d
InChI InChI=1S/C12H22O2/c1-3-14-12(13)10(2)9-11-7-5-4-6-8-11/h10-11H,3-9H2,1-2H3/i9D,10D
InChIKey PNTXMLPUPBGDPT-QDRJLNDYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H20D2O2
Exact Mass 200.174533 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFz6v04WRTx
Name 3-cyclohexyl-2,3-dideuterio-2-methyl-propionic acid ethyl ester
Alternate Name(s) 3-cyclohexyl-2,3-dideuterio-2-methylpropanoic acid ethyl ester Ethyl 3-cyclohexyl-2,3-dideuterio-2-methyl-propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20D2O2
InChI InChI=1S/C12H22O2/c1-3-14-12(13)10(2)9-11-7-5-4-6-8-11/h10-11H,3-9H2,1-2H3/i9D,10D
InChIKey PNTXMLPUPBGDPT-QDRJLNDYSA-N
Molecular Weight 200.318 g/mol
SMILES C(C(C(C1CCCCC1)[D])(C)[D])(=O)OCC
SPLASH splash10-0udi-0900000000-7ca1769b21bd021bb2e6
Source of Spectrum QE-7-4270-4
Wiley ID 846039