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Trans-1,2-bis(5-(benzyloxycarbonyl)-3,4-dimethyl-2-pyrrolyl)ethene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Trans-1,2-bis(5-(benzyloxycarbonyl)-3,4-dimethyl-2-pyrrolyl)ethene
SpectraBase Compound ID zvrE8OvUU9
InChI InChI=1S/C30H30N2O4/c1-19-21(3)27(29(33)35-17-23-11-7-5-8-12-23)31-25(19)15-16-26-20(2)22(4)28(32-26)30(34)36-18-24-13-9-6-10-14-24/h5-16,31-32H,17-18H2,1-4H3/b16-15+
InChIKey MMTKVWCBXFIKTG-FOCLMDBBSA-N
Mol Weight 482.58 g/mol
Molecular Formula C30H30N2O4
Exact Mass 482.220557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A1jjzTaVE9T
Name Trans-1,2-bis(5-(benzyloxycarbonyl)-3,4-dimethyl-2-pyrrolyl)ethene
Comments Computed using HOSE algorithm
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Exact Mass 482.220557450 u
Formula C30H30N2O4
InChI InChI=1S/C30H30N2O4/c1-19-21(3)27(29(33)35-17-23-11-7-5-8-12-23)31-25(19)15-16-26-20(2)22(4)28(32-26)30(34)36-18-24-13-9-6-10-14-24/h5-16,31-32H,17-18H2,1-4H3/b16-15+
InChIKey MMTKVWCBXFIKTG-FOCLMDBBSA-N
Molecular Weight 482.580 g/mol
SMILES C=1(NC(\C=C\C=2NC(C(OCC=3C=CC=CC3)=O)=C(C2C)C)=C(C1C)C)C(OCC=1C=CC=CC1)=O