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METHYL,12,13-DIACETOXYPODOCARPA-8,11,13-TRIEN-19-OATE
SpectraBase Compound ID 2o9ReFajwTW
InChI InChI=1S/C22H28O6/c1-13(23)27-17-11-15-7-8-19-21(3,16(15)12-18(17)28-14(2)24)9-6-10-22(19,4)20(25)26-5/h11-12,19H,6-10H2,1-5H3/t19-,21-,22+/m1/s1
InChIKey YNTUZQYIHIVFRI-FCEUIQTBSA-N
Mol Weight 388.46 g/mol
Molecular Formula C22H28O6
Exact Mass 388.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrNlOVubjVg
Name (1S,4aS,10aR)-6,7-diacetoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester
CAS Registry Number 3918-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O6
InChI InChI=1S/C22H28O6/c1-13(23)27-17-11-15-7-8-19-21(3,16(15)12-18(17)28-14(2)24)9-6-10-22(19,4)20(25)26-5/h11-12,19H,6-10H2,1-5H3/t19-,21-,22+/m1/s1
InChIKey YNTUZQYIHIVFRI-FCEUIQTBSA-N
Molecular Weight 388.460 g/mol
SMILES [C@]12(c3cc(OC(=O)C)c(cc3CC[C@]1([C@](C(=O)OC)(C)CCC2)[H])OC(=O)C)C
SPLASH splash10-0udi-2029000000-ea60467243c084e96633
Source of Spectrum B-43-498-21
Synonyms (1S,4aS,10aR)-6,7-diacetyloxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester Methyl (1S,4aS,10aR)-6,7-diacetoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate Methyl (1S,4aS,10aR)-6,7-diacetyloxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
Wiley ID 1363883