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2-butenoic acid, 3-[3,3a,4,5-tetrahydro-7-methoxy-3-(4-nitrophenyl)-2H-benz[g]indazol-2-yl]-, ethyl ester, (2Z)-
SpectraBase Compound ID FRer5dG22LL
InChI InChI=1S/C24H25N3O5/c1-4-32-22(28)13-15(2)26-24(16-5-8-18(9-6-16)27(29)30)21-11-7-17-14-19(31-3)10-12-20(17)23(21)25-26/h5-6,8-10,12-14,21,24H,4,7,11H2,1-3H3/b15-13-
InChIKey LEEWAGAMSISGKO-SQFISAMPSA-N
Mol Weight 435.48 g/mol
Molecular Formula C24H25N3O5
Exact Mass 435.179421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MTLCgOVYFS
Name (Z)-3-[7-methoxy-3-(4-nitrophenyl)-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]-2-butenoic acid ethyl ester
Alternate Name(s) (Z)-3-[7-methoxy-3-(4-nitrophenyl)-3,3a,4,5-tetrahydrobenz[g]indazol-2-yl]but-2-enoic acid ethyl ester Ethyl (Z)-3-[7-methoxy-3-(4-nitrophenyl)-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]but-2-enoate
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Formula C24H25N3O5
InChI InChI=1S/C24H25N3O5/c1-4-32-22(28)13-15(2)26-24(16-5-8-18(9-6-16)27(29)30)21-11-7-17-14-19(31-3)10-12-20(17)23(21)25-26/h5-6,8-10,12-14,21,24H,4,7,11H2,1-3H3/b15-13-
InChIKey LEEWAGAMSISGKO-SQFISAMPSA-N
Molecular Weight 435.480 g/mol
SMILES CCOC(\C=C\(N1N=C2c3c(cc(cc3)OC)CCC2C1c1ccc(N(=O)=O)cc1)C)=O
SPLASH splash10-00r5-1972000000-97b6d3fa808b26e00212
Wiley ID 1464339