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1,4-Bis((3-methyl-5-styrylisoxazole-4- ylamino)-(phenyl)methyl)naphthalene-2,3,diol
SpectraBase Compound ID 5kyFICq0xrB
InChI InChI=1S/C48H40N4O4/c1-31-43(39(55-51-31)29-27-33-17-7-3-8-18-33)49-45(35-21-11-5-12-22-35)41-37-25-15-16-26-38(37)42(48(54)47(41)53)46(36-23-13-6-14-24-36)50-44-32(2)52-56-40(44)30-28-34-19-9-4-10-20-34/h3-30,45-46,49-50,53-54H,1-2H3/b29-27+,30-28+
InChIKey UHFAODMDDFXGEW-QAVVBOBSSA-N
Mol Weight 736.9 g/mol
Molecular Formula C48H40N4O4
Exact Mass 736.304956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvWrk4vWyrF
Name 1,4-Bis((3-methyl-5-styrylisoxazole-4- ylamino)-(phenyl)methyl)naphthalene-2,3,diol
Alternate Name(s) 1,4-Bis(((3-methyl-5-((E)-styryl)isoxazol-4-yl)amino)(phenyl)methyl)naphthalene-2,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H40N4O4
InChI InChI=1S/C48H40N4O4/c1-31-43(39(55-51-31)29-27-33-17-7-3-8-18-33)49-45(35-21-11-5-12-22-35)41-37-25-15-16-26-38(37)42(48(54)47(41)53)46(36-23-13-6-14-24-36)50-44-32(2)52-56-40(44)30-28-34-19-9-4-10-20-34/h3-30,45-46,49-50,53-54H,1-2H3/b29-27+,30-28+
InChIKey UHFAODMDDFXGEW-QAVVBOBSSA-N
Molecular Weight 736.872 g/mol
SMILES N(C(c1c2ccccc2c(c(c1O)O)C(c1ccccc1)Nc1c(onc1C)\C=C\c1ccccc1)c1ccccc1)c1c(noc1\C=C\c1ccccc1)C
SPLASH splash10-0ul9-0895820100-534f3214bb629eadd72f
Source of Spectrum Y1-53B-415-4a
Wiley ID 1743614