| SpectraBase Spectrum ID |
4QAG3P6x21P |
| Name |
3,4-trans-2,2-Dimethyl-3-phenyl-4-(p-hydroxy-3'-nitrophenyl)-7-methoxychroman |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H23NO5 |
| InChI |
InChI=1S/C24H23NO5/c1-24(2)23(15-7-5-4-6-8-15)22(16-9-12-20(26)19(13-16)25(27)28)18-11-10-17(29-3)14-21(18)30-24/h4-14,22-23,26H,1-3H3/t22-,23+/m1/s1 |
| InChIKey |
XQFKDXWMJQPEDQ-PKTZIBPZSA-N |
| Molecular Weight |
405.450 g/mol |
| SMILES |
Oc1c(N(=O)=O)cc([C@@]2(c3c(cc(cc3)OC)OC([C@]2(c2ccccc2)[H])(C)C)[H])cc1 |
| SPLASH |
splash10-053r-0900800000-a50e268cb2e988c6fdf5 |
| Source of Spectrum |
Y1-33-542-3 |
| Wiley ID |
1526299 |
