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12-acetoxy-13-acetylpodocarpa-8,11,13-trien-7-one
SpectraBase Compound ID 66lOrnttTA2
InChI InChI=1S/C21H26O4/c1-12(22)14-9-15-16(10-18(14)25-13(2)23)21(5)8-6-7-20(3,4)19(21)11-17(15)24/h9-10,19H,6-8,11H2,1-5H3/t19?,21-/m1/s1
InChIKey VUPSXELSSPREKI-VGAJERRHSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CasIaMempGf
Name 12-acetoxy-13-acetylpodocarpa-8,11,13-trien-7-one
Alternate Name(s) 13-acetyl-7-oxopodocarpa-8,11,13-trien-12-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-12(22)14-9-15-16(10-18(14)25-13(2)23)21(5)8-6-7-20(3,4)19(21)11-17(15)24/h9-10,19H,6-8,11H2,1-5H3/t19?,21-/m1/s1
InChIKey VUPSXELSSPREKI-VGAJERRHSA-N
Molecular Weight 342.435 g/mol
SMILES c12[C@@]3(C(C(C)(C)CCC3)CC(c1cc(c(c2)OC(=O)C)C(=O)C)=O)C
SPLASH splash10-0udl-5039000000-59091377c108da95839e
Source of Spectrum B-46-1825-0
Wiley ID 1336810