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7(R*)-Acetoxy-13-keto-(1S*,11R*)-dolabella-3(E),8(17),12(18)-triene
SpectraBase Compound ID 9fzYxlB4MCU
InChI InChI=1S/C22H32O3/c1-14(2)21-18-9-8-16(4)20(25-17(5)23)10-7-15(3)11-12-22(18,6)13-19(21)24/h11,18,20H,4,7-10,12-13H2,1-3,5-6H3/b15-11+/t18-,20+,22-/m0/s1
InChIKey HPPRTZIERHJXQB-GZEBFJMTSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CY5HZV4IXLT
Name 7(R*)-Acetoxy-13-keto-(1S*,11R*)-dolabella-3(E),8(17),12(18)-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-14(2)21-18-9-8-16(4)20(25-17(5)23)10-7-15(3)11-12-22(18,6)13-19(21)24/h11,18,20H,4,7-10,12-13H2,1-3,5-6H3/b15-11+/t18-,20+,22-/m0/s1
InChIKey HPPRTZIERHJXQB-GZEBFJMTSA-N
Molecular Weight 344.495 g/mol
SMILES C1(C(C[C@]2([C@]1(CCC([C@](OC(=O)C)(CC\C(=C\C2)C)[H])=C)[H])C)=O)=C(C)C
SPLASH splash10-0k9i-0912000000-a5ba776c61bdea6d7db0
Source of Spectrum J-56-3398-7
Synonyms (3aR,7R,12aS)-10,12a-dimethyl-6-methylene-3-(1-methylethylidene)-2-oxo-1,2,3,3a,4,5,6,7,8,9,12,12a-dodecahydrocyclopenta[a]cycloundecen-7-yl acetate
Wiley ID 1338275