SpectraBase Spectrum ID |
Axlnlxr2dZS |
Name |
(4R,5R)-2,4-Bis-(1H-1,2,3-benzotriazol-1-yl)-5-(4-methylphenyl)cyclohexane-1,3-dione |
Appearance |
Dark yellow oil |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H20N6O2 |
InChI |
InChI=1S/C25H20N6O2/c1-15-10-12-16(13-11-15)17-14-22(32)24(31-21-9-5-3-7-19(21)27-29-31)25(33)23(17)30-20-8-4-2-6-18(20)26-28-30/h2-13,17,23-24H,14H2,1H3/t17-,23-,24?/m1/s1 |
InChIKey |
JYJCWAHEAVNYKP-KWTFHKEJSA-N |
Instrument Name |
HP 6890-5973 |
Ionization Type |
EI |
Literature Reference DOI |
10.3998/ark.5550190.0011.b26 |
Molecular Weight |
436.475 g/mol |
SMILES |
C1C(=O)C([n]2nnc3c2cccc3)C(=O)[C@@]([C@]1(c1ccc(cc1)C)[H])([n]1c2c(nn1)cccc2)[H] |
SPLASH |
splash10-00di-2190000000-b6597dd6d6880b4daf52 |
Source of Spectrum |
ARK-2010-339-7 |
Wiley ID |
1869971 |