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2-Heptanone, 7,7-dimethoxy-5-(1-methylethyl)-, (R)-
SpectraBase Compound ID CH5RNzOrZhE
InChI InChI=1S/C12H24O3/c1-9(2)11(7-6-10(3)13)8-12(14-4)15-5/h9,11-12H,6-8H2,1-5H3/t11-/m1/s1
InChIKey ZVUOYGFOXXOSAJ-LLVKDONJSA-N
Mol Weight 216.32 g/mol
Molecular Formula C12H24O3
Exact Mass 216.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FINcQEEVHT3
Name 2-Heptanone, 7,7-dimethoxy-5-(1-methylethyl)-, (R)-
CAS Registry Number 105897-85-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O3
InChI InChI=1S/C12H24O3/c1-9(2)11(7-6-10(3)13)8-12(14-4)15-5/h9,11-12H,6-8H2,1-5H3/t11-/m1/s1
InChIKey ZVUOYGFOXXOSAJ-LLVKDONJSA-N
Molecular Weight 216.321 g/mol
SMILES [C@@](CC(OC)OC)(CCC(=O)C)(C(C)C)[H]
SPLASH splash10-0159-9210000000-64b74895dd03199ed31e
Source of Spectrum C-111-6705-55
Synonyms (5R)-5-isopropyl-7,7-dimethoxy-heptan-2-one (5R)-7,7-dimethoxy-5-propan-2-yl-2-heptanone (5R)-7,7-dimethoxy-5-propan-2-yl-heptan-2-one
Wiley ID 1215610