| SpectraBase Spectrum ID |
9WLbmJ5zUNd |
| Name |
1-(4"-Methyl-2"-nitrophenyl)-2-(3',4',5'-trimethoxyphenyl)ethyne |
| Alternate Name(s) |
1,2,3-trimethoxy-5-[(4-methyl-2-nitrophenyl)ethynyl]benzene
1-(4''-Methyl-2''-nitrophenyl)-2-(3',4',5'-trimethoxyphenyl)ethyne |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17NO5 |
| InChI |
InChI=1S/C18H17NO5/c1-12-5-7-14(15(9-12)19(20)21)8-6-13-10-16(22-2)18(24-4)17(11-13)23-3/h5,7,9-11H,1-4H3 |
| InChIKey |
JLKKNNNVHKSWRS-UHFFFAOYSA-N |
| Molecular Weight |
327.336 g/mol |
| SMILES |
c1(N(=O)=O)c(C#Cc2cc(OC)c(c(c2)OC)OC)ccc(c1)C |
| SPLASH |
splash10-01t9-0009000000-cddc894d80668813e59d |
| Source of Spectrum |
SK-28-1426-14 |
| Wiley ID |
868295 |
