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1,4-Bis(((5-((E)-4-methoxystyryl)-3-methylisoxazol-4-yl)amino)(phenyl)methyl)naphthalene-2,3-diol

View entire compound with spectra: 1 MS (GC)

1,4-Bis(((5-((E)-4-methoxystyryl)-3-methylisoxazol-4-yl)amino)(phenyl)methyl)naphthalene-2,3-diol
SpectraBase Compound ID 4eVtOqRfqFp
InChI InChI=1S/C50H44N4O6/c1-31-45(41(59-53-31)29-23-33-19-25-37(57-3)26-20-33)51-47(35-13-7-5-8-14-35)43-39-17-11-12-18-40(39)44(50(56)49(43)55)48(36-15-9-6-10-16-36)52-46-32(2)54-60-42(46)30-24-34-21-27-38(58-4)28-22-34/h5-30,47-48,51-52,55-56H,1-4H3/b29-23+,30-24+
InChIKey VGUJRIGPBZGRJO-HCTXVGCHSA-N
Mol Weight 796.9 g/mol
Molecular Formula C50H44N4O6
Exact Mass 796.326085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ia8sojXLNPC
Name 1,4-Bis(((5-((E)-4-methoxystyryl)-3-methylisoxazol-4-yl)amino)(phenyl)methyl)naphthalene-2,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C50H44N4O6
InChI InChI=1S/C50H44N4O6/c1-31-45(41(59-53-31)29-23-33-19-25-37(57-3)26-20-33)51-47(35-13-7-5-8-14-35)43-39-17-11-12-18-40(39)44(50(56)49(43)55)48(36-15-9-6-10-16-36)52-46-32(2)54-60-42(46)30-24-34-21-27-38(58-4)28-22-34/h5-30,47-48,51-52,55-56H,1-4H3/b29-23+,30-24+
InChIKey VGUJRIGPBZGRJO-HCTXVGCHSA-N
Molecular Weight 796.924 g/mol
SMILES Oc1c(c(c2c(c1C(Nc1c(onc1C)\C=C\c1ccc(cc1)OC)c1ccccc1)cccc2)C(Nc1c(onc1C)\C=C\c1ccc(cc1)OC)c1ccccc1)O
SPLASH splash10-0r03-0290637500-a49cd73d789bc44a840f
Source of Spectrum Y1-53B-415-4c
Wiley ID 1743615