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2',3',4',5',6'-Pentamethylphenyl 2,3-dihydro-2-oxo-5-phenyl-3-[(E)-(phenyl)(2'',3'',4'',5'',6''-pentamethylphenyl)methylidene]furan-4-carboxylate

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2',3',4',5',6'-Pentamethylphenyl 2,3-dihydro-2-oxo-5-phenyl-3-[(E)-(phenyl)(2'',3'',4'',5'',6''-pentamethylphenyl)methylidene]furan-4-carboxylate
SpectraBase Compound ID 2YV9UYtC31j
InChI InChI=1S/C40H40O4/c1-21-23(3)27(7)33(28(8)24(21)4)34(31-17-13-11-14-18-31)35-36(38(44-39(35)41)32-19-15-12-16-20-32)40(42)43-37-29(9)25(5)22(2)26(6)30(37)10/h11-20H,1-10H3/b35-34+
InChIKey ILXUQVXJVZISPO-XAHDOWKMSA-N
Mol Weight 584.8 g/mol
Molecular Formula C40H40O4
Exact Mass 584.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FCsXkkq1UD
Name 2',3',4',5',6'-Pentamethylphenyl 2,3-dihydro-2-oxo-5-phenyl-3-[(E)-(phenyl)(2'',3'',4'',5'',6''-pentamethylphenyl)methylidene]furan-4-carboxylate
Alternate Name(s) 2,3,4,5,6-pentamethylphenyl (4E)-5-oxo-4-[(2,3,4,5,6-pentamethylphenyl)(phenyl)methylene]-2-phenyl-4,5-dihydro-3-furancarboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H40O4
InChI InChI=1S/C40H40O4/c1-21-23(3)27(7)33(28(8)24(21)4)34(31-17-13-11-14-18-31)35-36(38(44-39(35)41)32-19-15-12-16-20-32)40(42)43-37-29(9)25(5)22(2)26(6)30(37)10/h11-20H,1-10H3/b35-34+
InChIKey ILXUQVXJVZISPO-XAHDOWKMSA-N
Molecular Weight 584.756 g/mol
SMILES C=1(\C(=C/(c2c(c(C)c(c(c2C)C)C)C)c2ccccc2)C(=O)OC1c1ccccc1)C(Oc1c(c(C)c(c(c1C)C)C)C)=O
SPLASH splash10-00di-0000900000-b94c2e7b5a6973beeda3
Source of Spectrum H-84-3572-0
Wiley ID 847910