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(+)-(1S,4R,5S,6R)-6-Acetyl-4,8,8-trimethylbicyclo[3.3.1]nonan-3-one
SpectraBase Compound ID F6NOvyVxB1e
InChI InChI=1S/C14H22O2/c1-8-11-5-10(6-13(8)16)14(3,4)7-12(11)9(2)15/h8,10-12H,5-7H2,1-4H3/t8-,10+,11+,12+/m1/s1
InChIKey MQEVCDOVZNQZLR-QTKMDUPCSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F4XKAoxXvvr
Name (+)-(1S,4R,5S,6R)-6-Acetyl-4,8,8-trimethylbicyclo[3.3.1]nonan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-8-11-5-10(6-13(8)16)14(3,4)7-12(11)9(2)15/h8,10-12H,5-7H2,1-4H3/t8-,10+,11+,12+/m1/s1
InChIKey MQEVCDOVZNQZLR-QTKMDUPCSA-N
Molecular Weight 222.328 g/mol
SMILES [C@]12([C@@](CC([C@](C2)([H])CC([C@@]1(C)[H])=O)(C)C)(C(=O)C)[H])[H]
SPLASH splash10-0a4i-1900000000-72764ae8fc47b96ab7fc
Source of Spectrum F-50-8789-11
Synonyms (1S,2R,5S,8R)-8-acetyl-2,6,6-trimethylbicyclo[3.3.1]nonan-3-one
Wiley ID 1223014