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4H-Pyran-4-one, tetrahydro-6-(hydroxymethyl)-3,3-dimethyl-2-propyl-, trans-(.+-.)-
SpectraBase Compound ID JD9YIlMNu0K
InChI InChI=1S/C11H20O3/c1-4-5-10-11(2,3)9(13)6-8(7-12)14-10/h8,10,12H,4-7H2,1-3H3/t8-,10+/m1/s1
InChIKey KQKJNCQLHISACW-SCZZXKLOSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DvUk1lFtf8
Name 4H-Pyran-4-one, tetrahydro-6-(hydroxymethyl)-3,3-dimethyl-2-propyl-, trans-(.+-.)-
Alternate Name(s) (2S,6R)-6-(hydroxymethyl)-3,3-dimethyl-2-propyltetrahydro-4H-pyran-4-one trans-1-oxa-6-hydroxymethyl-3,,3-dimethyl-2-propylcyclohexan-4-one
CAS Registry Number 88195-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-4-5-10-11(2,3)9(13)6-8(7-12)14-10/h8,10,12H,4-7H2,1-3H3/t8-,10+/m1/s1
InChIKey KQKJNCQLHISACW-SCZZXKLOSA-N
Molecular Weight 200.278 g/mol
SMILES OC[C@@]1(O[C@](C(C(C1)=O)(C)C)(CCC)[H])[H]
SPLASH splash10-00fr-9500000000-4670c9ecb113aca66e4b
Source of Spectrum KC-1985-2098-10
Wiley ID 1197744