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(Z)-3-(9-methyl-2-carbazolyl)-2-(triphenylphosphoranylideneamino)-2-propenoic acid ethyl ester
SpectraBase Compound ID 1h6gASB3gFB
InChI InChI=1S/C36H31N2O2P/c1-3-40-36(39)33(25-27-23-24-32-31-21-13-14-22-34(31)38(2)35(32)26-27)37-41(28-15-7-4-8-16-28,29-17-9-5-10-18-29)30-19-11-6-12-20-30/h4-26H,3H2,1-2H3/b33-25-
InChIKey DVYYRCXIWVQJLH-IVQJCJPDSA-N
Mol Weight 554.6 g/mol
Molecular Formula C36H31N2O2P
Exact Mass 554.212315 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmNTDXRfbTg
Name (Z)-3-(9-methyl-2-carbazolyl)-2-(triphenylphosphoranylideneamino)-2-propenoic acid ethyl ester
Alternate Name(s) (Z)-3-(9-methylcarbazol-2-yl)-2-(triphenylphosphoranylideneamino)acrylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C36H31N2O2P
InChI InChI=1S/C36H31N2O2P/c1-3-40-36(39)33(25-27-23-24-32-31-21-13-14-22-34(31)38(2)35(32)26-27)37-41(28-15-7-4-8-16-28,29-17-9-5-10-18-29)30-19-11-6-12-20-30/h4-26H,3H2,1-2H3/b33-25-
InChIKey DVYYRCXIWVQJLH-IVQJCJPDSA-N
Molecular Weight 554.630 g/mol
SMILES c12[n](c3c(c2ccc(\C=C\(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)OCC)c1)cccc3)C
SPLASH splash10-014i-9000000000-c849ac956a10b0b2f930
Source of Spectrum F-47-4182-3
Wiley ID 1406252