| SpectraBase Spectrum ID |
AY46CGxjQP1 |
| Name |
4,4-bis(4'-Hydroxy-3',5'-dimethylphenyl)heptanedinitrile |
| Alternate Name(s) |
4,4-bis(4-hydroxy-3,5-dimethylphenyl)heptanedinitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H26N2O2 |
| InChI |
InChI=1S/C23H26N2O2/c1-15-11-19(12-16(2)21(15)26)23(7-5-9-24,8-6-10-25)20-13-17(3)22(27)18(4)14-20/h11-14,26-27H,5-8H2,1-4H3 |
| InChIKey |
LJVSFHPCAXMHFJ-UHFFFAOYSA-N |
| Molecular Weight |
362.473 g/mol |
| SMILES |
Oc1c(cc(C(c2cc(c(c(c2)C)O)C)(CCC#N)CCC#N)cc1C)C |
| SPLASH |
splash10-0a4i-0009000000-3c5e9e7a065c05bdb565 |
| Source of Spectrum |
H-82-1089-27 |
| Wiley ID |
815424 |
