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Cyclonona[c]pyran-3(1H)-one, 4,4a,5,6,9,10,11,11a-octahydro-7-methyl-11-methylene-4-(4-methyl-3-pentenylidene)-, (4E,4aR*,7E,11aS*)-(+)-

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

Cyclonona[c]pyran-3(1H)-one, 4,4a,5,6,9,10,11,11a-octahydro-7-methyl-11-methylene-4-(4-methyl-3-pentenylidene)-, (4E,4aR*,7E,11aS*)-(+)-
SpectraBase Compound ID KosZDwGPv4t
InChI InChI=1S/C20H28O2/c1-14(2)7-5-10-18-17-12-11-15(3)8-6-9-16(4)19(17)13-22-20(18)21/h7-8,10,17,19H,4-6,9,11-13H2,1-3H3/b15-8-,18-10+/t17-,19+/m0/s1
InChIKey SQJLXMDBYVXCEL-SORDANKJSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CpQD0ElwWlq
Name Cyclonona[C]pyran-3(1H)-one, 4,4A,5,6,9,10,11,11A-octahydro-7-methyl-11-methylene-4-(4-methyl-3-pentenylidene)-, (4E,4ar*,7E,11AS*)-(+)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.208930140 u
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-14(2)7-5-10-18-17-12-11-15(3)8-6-9-16(4)19(17)13-22-20(18)21/h7-8,10,17,19H,4-6,9,11-13H2,1-3H3/b15-8-,18-10+/t17-,19+/m0/s1
InChIKey SQJLXMDBYVXCEL-SORDANKJSA-N
SMILES [C@]12(\C(C(OC[C@@]2(C(=C)CC\C=C/(CC1)C)[H])=O)=C/CC=C(C)C)[H]