| SpectraBase Spectrum ID |
5XKOC5W8LY |
| Name |
(4-cyanophenyl) 2-undecyl-3,4-dihydro-2H-chromene-6-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H35NO3 |
| InChI |
InChI=1S/C28H35NO3/c1-2-3-4-5-6-7-8-9-10-11-25-18-14-23-20-24(15-19-27(23)31-25)28(30)32-26-16-12-22(21-29)13-17-26/h12-13,15-17,19-20,25H,2-11,14,18H2,1H3 |
| InChIKey |
LVJAMUJUIZIUQT-UHFFFAOYSA-N |
| Molecular Weight |
433.592 g/mol |
| SMILES |
C(c1cc2CCC(Oc2cc1)CCCCCCCCCCC)(Oc1ccc(C#N)cc1)=O |
| SPLASH |
splash10-014i-0009000000-c225eefaef5da77e1202 |
| Source of Spectrum |
J-59-5935-7 |
| Synonyms |
(4-cyanophenyl) 2-undecylchromane-6-carboxylate
2-undecyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid (4-cyanophenyl) ester
2-undecylchroman-6-carboxylic acid (4-cyanophenyl) ester |
| Wiley ID |
1382748 |
