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4-(2,6-Dimethoxy-4-pentylphenyl)-6,6-dimethylbicyclo[3.1.1]heptan-2-one
SpectraBase Compound ID 5wbx61P1s2Y
InChI InChI=1S/C22H32O3/c1-6-7-8-9-14-10-19(24-4)21(20(11-14)25-5)15-12-18(23)17-13-16(15)22(17,2)3/h10-11,15-17H,6-9,12-13H2,1-5H3
InChIKey NIJLSDJCARJMQS-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9UKxtHEdcJ
Name 4-(2,6-Dimethoxy-4-pentylphenyl)-6,6-dimethylbicyclo[3.1.1]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-6-7-8-9-14-10-19(24-4)21(20(11-14)25-5)15-12-18(23)17-13-16(15)22(17,2)3/h10-11,15-17H,6-9,12-13H2,1-5H3
InChIKey NIJLSDJCARJMQS-UHFFFAOYSA-N
Molecular Weight 344.495 g/mol
SMILES C12C(CC(C(C2(C)C)C1)c1c(cc(cc1OC)CCCCC)OC)=O
SPLASH splash10-0089-0093000000-4f096e5a6e75f3a42b13
Source of Spectrum F-51-1026-0
Wiley ID 790812