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4-Hydroxy-1,9-Dimethoxy-3-[(2,3-(dimethoxycarbonyl)eth-1-yl)methyl]phenathrene
SpectraBase Compound ID CoUbAcpANTt
InChI InChI=1S/C23H24O7/c1-27-18-10-13(9-14(23(26)30-4)11-20(24)29-3)22(25)21-16-8-6-5-7-15(16)19(28-2)12-17(18)21/h5-8,10,12,14,25H,9,11H2,1-4H3
InChIKey SPVBCTCWURJPFM-UHFFFAOYSA-N
Mol Weight 412.44 g/mol
Molecular Formula C23H24O7
Exact Mass 412.152203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gaZJoWlXvq
Name 4-Hydroxy-1,9-Dimethoxy-3-[(2,3-(dimethoxycarbonyl)eth-1-yl)methyl]phenathrene
Alternate Name(s) 2-(4-Hydroxy-1,9-dimethoxy-phenanthren-3-ylmethyl)-succinic acid dimethyl ester dimethyl 2-[(4-hydroxy-1,9-dimethoxy-3-phenanthryl)methyl]succinate
Comments Less than 3 mono-isotopic peaks
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Formula C23H24O7
InChI InChI=1S/C23H24O7/c1-27-18-10-13(9-14(23(26)30-4)11-20(24)29-3)22(25)21-16-8-6-5-7-15(16)19(28-2)12-17(18)21/h5-8,10,12,14,25H,9,11H2,1-4H3
InChIKey SPVBCTCWURJPFM-UHFFFAOYSA-N
Molecular Weight 412.438 g/mol
SMILES Oc1c(cc(c2c1c1c(c(OC)c2)cccc1)OC)CC(C(=O)OC)CC(=O)OC
SPLASH splash10-001i-0009000000-7aa7134696c2ac8511de
Source of Spectrum C-116-7114-56
Wiley ID 1374452