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DITERPENE CB-VII
SpectraBase Compound ID BgGPE7OW0mR
InChI InChI=1S/C20H30O3/c1-18(2)8-4-9-19(3)15(18)7-10-20(12-21)14-11-23-17(22)13(14)5-6-16(19)20/h12-16H,4-11H2,1-3H3/t13-,14-,15?,16?,19+,20-/m1/s1
InChIKey ATTVOBVGYCVEIL-ZBMTYHIRSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ev9F4APuhu
Name (-)-Spongian-16-oxo-17-al
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-18(2)8-4-9-19(3)15(18)7-10-20(12-21)14-11-23-17(22)13(14)5-6-16(19)20/h12-16H,4-11H2,1-3H3/t13-,14-,15?,16?,19+,20-/m1/s1
InChIKey ATTVOBVGYCVEIL-ZBMTYHIRSA-N
Molecular Weight 318.457 g/mol
SMILES [C@]12(C([C@]3(CCCC(C3CC2)(C)C)C)CC[C@@]2([C@]1(COC2=O)[H])[H])C=O
SPLASH splash10-014i-0291000000-887499a2a5063008cf0c
Source of Spectrum F-68-1250-2
Synonyms (3aR,3bS,9aS,11aR)-6,6,9a-trimethyl-1-oxo-3,3a,4,5,5a,7,8,9,9b,10,11,11a-dodecahydronaphtho[2,1-e]isobenzofuran-3b-carboxaldehyde (3aR,3bS,9aS,11aR)-6,6,9a-trimethyl-1-oxo-3,3a,4,5,5a,7,8,9,9b,10,11,11a-dodecahydronaphtho[2,1-e][2]benzofuran-3b-carbaldehyde (3aR,3bS,9aS,11aR)-6,6,9a-trimethyl-1-oxo-3,3a,4,5,5a,7,8,9,9b,10,11,11a-dodecahydronaphtho[2,1-e]isobenzofuran-3b-carbaldehyde (3aR,3bS,9aS,11aR)-6,6,9a-trimethyl-1-oxidanylidene-3,3a,4,5,5a,7,8,9,9b,10,11,11a-dodecahydronaphtho[2,1-e][2]benzofuran-3b-carbaldehyde
Wiley ID 1571794