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(3R,4S,6R)-6-Isopropyl-3,4-dimethyl-tetrahydro-pyran-2-one
SpectraBase Compound ID 8CEJtLFT0TL
InChI InChI=1S/C10H18O2/c1-6(2)9-5-7(3)8(4)10(11)12-9/h6-9H,5H2,1-4H3/t7-,8+,9+/m0/s1
InChIKey VKJBAILOVALTBK-DJLDLDEBSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dmPDFsnTXB
Name (3R,4S,6R)-6-Isopropyl-3,4-dimethyl-tetrahydro-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-6(2)9-5-7(3)8(4)10(11)12-9/h6-9H,5H2,1-4H3/t7-,8+,9+/m0/s1
InChIKey VKJBAILOVALTBK-DJLDLDEBSA-N
Molecular Weight 170.252 g/mol
SMILES C1(O[C@@](C(C)C)(C[C@@]([C@]1(C)[H])(C)[H])[H])=O
SPLASH splash10-00c1-9300000000-50ccb9701756eaf8e817
Source of Spectrum F5-2-2400-36
Synonyms 3,4-Dimethyl-6-isopropyl-tetrahydropyran-2-one (3R,4S,6R)-6-isopropyl-3,4-dimethyltetrahydro-2H-pyran-2-one (3R,4S,6R)-3,4-dimethyl-6-propan-2-yl-2-oxanone (3R,4S,6R)-3,4-dimethyl-6-propan-2-yloxan-2-one (3R,4S,6R)-3,4-dimethyl-6-propan-2-yl-oxan-2-one
Wiley ID 1731941