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5-Azulenepropanal, 6-formyldecahydro-3a,6-dimethyl-.beta.-methylene-1-(1-methylethenyl)- , (1.alpha.,3a.beta.,5.alpha.,6.beta.,8a.alpha.)-

View entire compound with spectra: 1 MS (GC)

5-Azulenepropanal, 6-formyldecahydro-3a,6-dimethyl-.beta.-methylene-1-(1-methylethenyl)- , (1.alpha.,3a.beta.,5.alpha.,6.beta.,8a.alpha.)-
SpectraBase Compound ID 7m8An8g5MjR
InChI InChI=1S/C20H30O2/c1-14(2)16-6-9-19(4)12-18(15(3)8-11-21)20(5,13-22)10-7-17(16)19/h11,13,16-18H,1,3,6-10,12H2,2,4-5H3/t16-,17-,18+,19+,20-/m0/s1
InChIKey GZWJDHRNEPZVGH-OMZCGLGVSA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KY5c6SPz7L4
Name 5-Azulenepropanal, 6-formyldecahydro-3a,6-dimethyl-.beta.-methylene-1-(1-methylethenyl)- , (1.alpha.,3a.beta.,5.alpha.,6.beta.,8a.alpha.)-
Alternate Name(s) (1R,3aR,5R,6R,8aS)-1-isopropenyl-3a,6-dimethyl-5-[1-(2-oxoethyl)vinyl]decahydro-6-azulenecarbaldehyde 3,4-Dioxo-3,4-secoclavulara-17-ene
CAS Registry Number 69301-45-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-14(2)16-6-9-19(4)12-18(15(3)8-11-21)20(5,13-22)10-7-17(16)19/h11,13,16-18H,1,3,6-10,12H2,2,4-5H3/t16-,17-,18+,19+,20-/m0/s1
InChIKey GZWJDHRNEPZVGH-OMZCGLGVSA-N
Molecular Weight 302.458 g/mol
SMILES [C@@]12([C@]([C@](C(=C)C)(CC2)[H])(CC[C@]([C@](C1)(C(=C)CC=O)[H])(C=O)C)[H])C
SPLASH splash10-0f79-0897000000-4f664dd581d15be7330d
Source of Spectrum F-34-1556-0
Wiley ID 1305105