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ethyl (E)-(12-methoxy-19-norpodocarpa-8,11,13-trien-18-ylidene)acetate
SpectraBase Compound ID GJ3Cy13hvcO
InChI InChI=1S/C21H28O3/c1-4-24-20(22)12-9-15-6-5-13-21(2)18(15)11-8-16-7-10-17(23-3)14-19(16)21/h7,9-10,12,14-15,18H,4-6,8,11,13H2,1-3H3/b12-9+/t15-,18?,21-/m0/s1
InChIKey WLWZJZNHVFUWEI-QWPMBHLQSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C2daS29KkQK
Name ethyl (E)-(12-methoxy-19-norpodocarpa-8,11,13-trien-18-ylidene)acetate
Alternate Name(s) ethyl (2E)-3-[(1R,4aS)-6-methoxy-4a-methyl-1,2,3,4,4a,9,10,10a-octahydro-1-phenanthrenyl]-2-propenoate
Comments Less than 3 mono-isotopic peaks
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Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-4-24-20(22)12-9-15-6-5-13-21(2)18(15)11-8-16-7-10-17(23-3)14-19(16)21/h7,9-10,12,14-15,18H,4-6,8,11,13H2,1-3H3/b12-9+/t15-,18?,21-/m0/s1
InChIKey WLWZJZNHVFUWEI-QWPMBHLQSA-N
Molecular Weight 328.452 g/mol
SMILES [C@]12(c3c(ccc(c3)OC)CCC1[C@](\C=C\C(=O)OCC)(CCC2)[H])C
SPLASH splash10-004i-0009000000-747da2f7adc64535bb8b
Source of Spectrum B-46-593-0
Wiley ID 1326694