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6(1H)-Azulenone, octahydro-1,4-dimethoxy-1,4-dimethyl-7-(1-methylethylidene)-, (1.alpha.,3a.alpha.,4.alpha.,8a.alpha.)-(.+-.)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

6(1H)-Azulenone, octahydro-1,4-dimethoxy-1,4-dimethyl-7-(1-methylethylidene)-, (1.alpha.,3a.alpha.,4.alpha.,8a.alpha.)-(.+-.)-
SpectraBase Compound ID 8M4ioz28aXw
InChI InChI=1S/C17H28O3/c1-11(2)12-9-14-13(7-8-16(14,3)19-5)17(4,20-6)10-15(12)18/h13-14H,7-10H2,1-6H3/t13-,14-,16-,17?/m1/s1
InChIKey MJZVFSFYOBYUGX-QPSDVIFUSA-N
Mol Weight 280.41 g/mol
Molecular Formula C17H28O3
Exact Mass 280.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G2VhFw7QRWn
Name 6(1H)-Azulenone, octahydro-1,4-dimethoxy-1,4-dimethyl-7-(1-methylethylidene)-, (1.alpha.,3A.alpha.,4.alpha.,8A.alpha.)-(.+-.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.203844759 u
Formula C17H28O3
InChI InChI=1S/C17H28O3/c1-11(2)12-9-14-13(7-8-16(14,3)19-5)17(4,20-6)10-15(12)18/h13-14H,7-10H2,1-6H3/t13-,14-,16-,17?/m1/s1
InChIKey MJZVFSFYOBYUGX-QPSDVIFUSA-N
SMILES C1(C(CC(OC)(C)[C@]2([C@@](C1)([C@@](CC2)(OC)C)[H])[H])=O)=C(C)C