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16-demethylene-16-oxa-13,16-methano-kaurenic acid methyl ester 15,17-dione dev.
SpectraBase Compound ID GzISHTs1gHy
InChI InChI=1S/C20H28O5/c1-18-8-4-9-19(2,16(22)24-3)13(18)7-10-20-11-12(5-6-14(18)20)15(21)25-17(20)23/h12-14H,4-11H2,1-3H3/t12-,13-,14+,18+,19-,20-/m1/s1
InChIKey DDVPTOWCLIZYAV-IHRDMLOVSA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DQreUg2jOSg
Name 16-demethylene-16-oxa-13,16-methano-kaurenic acid methyl ester 15,17-dione dev.
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-18-8-4-9-19(2,16(22)24-3)13(18)7-10-20-11-12(5-6-14(18)20)15(21)25-17(20)23/h12-14H,4-11H2,1-3H3/t12-,13-,14+,18+,19-,20-/m1/s1
InChIKey DDVPTOWCLIZYAV-IHRDMLOVSA-N
Molecular Weight 348.439 g/mol
SMILES [C@@]123C(OC(=O)[C@@](C3)(CC[C@]1([C@@]1([C@@]([C@](C(=O)OC)(CCC1)C)([H])CC2)C)[H])[H])=O
SPLASH splash10-0avl-8940000000-05d9e6eca8c8d32c0e76
Source of Spectrum F2-46-1304-58
Wiley ID 1690266