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Methyl 8.beta.-(t-butyl)peroxy-12-oxopodocarpa-9,13-dien-19-oate
SpectraBase Compound ID IZqgyheKXeZ
InChI InChI=1S/C22H32O5/c1-19(2,3)26-27-22-12-8-15(23)14-17(22)20(4)10-7-11-21(5,18(24)25-6)16(20)9-13-22/h8,12,14,16H,7,9-11,13H2,1-6H3/t16?,20-,21-,22-/m0/s1
InChIKey GLRZHIGFCNVMQW-DQEAWVJBSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UUnpdtq7Lr
Name Methyl 8.beta.-(t-butyl)peroxy-12-oxopodocarpa-9,13-dien-19-oate
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Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-19(2,3)26-27-22-12-8-15(23)14-17(22)20(4)10-7-11-21(5,18(24)25-6)16(20)9-13-22/h8,12,14,16H,7,9-11,13H2,1-6H3/t16?,20-,21-,22-/m0/s1
InChIKey GLRZHIGFCNVMQW-DQEAWVJBSA-N
Molecular Weight 376.493 g/mol
SMILES C1=2[C@@]3(C([C@](C(=O)OC)(C)CCC3)CC[C@]1(C=CC(C2)=O)OOC(C)(C)C)C
SPLASH splash10-0f9i-0292000000-475ba2e76d2ac8c07d85
Source of Spectrum B-51-939-26
Synonyms (1S,4aS,8aR)-8a-tert-Butylperoxy-1,4a-dimethyl-6-oxo-1,2,3,4,4a,6,8a,9,10,10a-decahydro-phenanthrene-1-carboxylic acid methyl ester
Wiley ID 745705