SpectraBase Spectrum ID |
EEUsjh7NWTi |
Name |
3-[5'-(Adamantan-1-yl)-3'-hydroxybiphenyl-4-yl]-acrylic Acid |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H26O3 |
InChI |
InChI=1S/C25H26O3/c26-23-11-21(20-4-1-16(2-5-20)3-6-24(27)28)10-22(12-23)25-13-17-7-18(14-25)9-19(8-17)15-25/h1-6,10-12,17-19,26H,7-9,13-15H2,(H,27,28)/b6-3+/t17-,18+,19-,25- |
InChIKey |
YZRXDBPFFRVVME-ORXYZWTBSA-N |
Molecular Weight |
374.480 g/mol |
SMILES |
OC(\C=C\c1ccc(-c2cc(cc(c2)C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])O)cc1)=O |
SPLASH |
splash10-052b-9006000000-91b1b004511bd1dadfbc |
Source of Spectrum |
AF-48-4945-37 |
Synonyms |
(E)-3-[4-[3-(1-adamantyl)-5-hydroxyphenyl]phenyl]-2-propenoic acid
(E)-3-[4-[3-(1-adamantyl)-5-hydroxyphenyl]phenyl]prop-2-enoic acid
(E)-3-[4-[3-(1-adamantyl)-5-hydroxy-phenyl]phenyl]prop-2-enoic acid
(E)-3-[4-[3-(1-adamantyl)-5-oxidanyl-phenyl]phenyl]prop-2-enoic acid |
Wiley ID |
1693972 |