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3-(3''-Adamantan-1''-yl)-4'-hydroxybiphenyl-4-yl)acrylic Acid-o-Aminophenylamide
SpectraBase Compound ID ApE71uwjJht
InChI InChI=1S/C31H32N2O2/c32-27-3-1-2-4-28(27)33-30(35)12-7-20-5-8-24(9-6-20)25-10-11-29(34)26(16-25)31-17-21-13-22(18-31)15-23(14-21)19-31/h1-12,16,21-23,34H,13-15,17-19,32H2,(H,33,35)/b12-7+/t21-,22+,23-,31-
InChIKey DWNQOPMOUOSBEO-HNALPPARSA-N
Mol Weight 464.6 g/mol
Molecular Formula C31H32N2O2
Exact Mass 464.246378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6233b7vu0aM
Name 3-(3''-Adamantan-1''-yl)-4'-hydroxybiphenyl-4-yl)acrylic Acid-o-Aminophenylamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H32N2O2
InChI InChI=1S/C31H32N2O2/c32-27-3-1-2-4-28(27)33-30(35)12-7-20-5-8-24(9-6-20)25-10-11-29(34)26(16-25)31-17-21-13-22(18-31)15-23(14-21)19-31/h1-12,16,21-23,34H,13-15,17-19,32H2,(H,33,35)/b12-7+/t21-,22+,23-,31-
InChIKey DWNQOPMOUOSBEO-HNALPPARSA-N
Molecular Weight 464.609 g/mol
SMILES N(C(\C=C\c1ccc(-c2cc(c(cc2)O)C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])cc1)=O)c1c(cccc1)N
SPLASH splash10-052b-0005900000-1e4279b53fa8711b0989
Source of Spectrum AF-48-4939-7b
Synonyms (E)-3-[4-[3-(1-adamantyl)-4-hydroxyphenyl]phenyl]-N-(2-aminophenyl)-2-propenamide (E)-3-[4-[3-(1-adamantyl)-4-hydroxyphenyl]phenyl]-N-(2-aminophenyl)prop-2-enamide (E)-3-[4-[3-(1-adamantyl)-4-hydroxy-phenyl]phenyl]-N-(2-aminophenyl)prop-2-enamide (E)-3-[4-[3-(1-adamantyl)-4-oxidanyl-phenyl]phenyl]-N-(2-aminophenyl)prop-2-enamide
Wiley ID 1693984