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2-(3,4,5-Trimethoxyphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
SpectraBase Compound ID Li4kg0UGX8C
InChI InChI=1S/C21H17NO5/c1-25-16-10-13(11-17(26-2)19(16)27-3)22-20(23)14-8-4-6-12-7-5-9-15(18(12)14)21(22)24/h4-11H,1-3H3
InChIKey IJCJOPTZJRPDFW-UHFFFAOYSA-N
Mol Weight 363.37 g/mol
Molecular Formula C21H17NO5
Exact Mass 363.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3vJ7p6gQM7S
Name 2-(3,4,5-Trimethoxyphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Alternate Name(s) 2-(3,4,5-trimethoxyphenyl)benzo[de]isoquinoline-1,3-dione
Comments Less than 3 mono-isotopic peaks
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Formula C21H17NO5
InChI InChI=1S/C21H17NO5/c1-25-16-10-13(11-17(26-2)19(16)27-3)22-20(23)14-8-4-6-12-7-5-9-15(18(12)14)21(22)24/h4-11H,1-3H3
InChIKey IJCJOPTZJRPDFW-UHFFFAOYSA-N
Molecular Weight 363.369 g/mol
SMILES C1(N(C(c2c3c(cccc13)ccc2)=O)c1cc(OC)c(c(c1)OC)OC)=O
SPLASH splash10-03di-0009000000-65e6943c27e1c76dbe55
Source of Spectrum F2-45-1652-11b
Wiley ID 1703428