SpectraBase Compound ID | GX9DM34kmAq |
---|---|
InChI | InChI=1S/C14H8IN3O4/c15-9-5-8(6-10(7-9)18(20)21)13-16-17-14(22-13)11-3-1-2-4-12(11)19/h1-7,19H |
InChIKey | MTMCXQDBTYMLQT-UHFFFAOYSA-N |
Mol Weight | 409.14 g/mol |
Molecular Formula | C14H8IN3O4 |
Exact Mass | 408.955951 g/mol |
SpectraBase Spectrum ID | Aa9B7MJssz6 |
---|---|
Name | Phenol, 2-[5-(3-iodo-5-nitrophenyl)-[1,3,4]oxadiazol-2-yl]- |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C14H8IN3O4 |
InChI | InChI=1S/C14H8IN3O4/c15-9-5-8(6-10(7-9)18(20)21)13-16-17-14(22-13)11-3-1-2-4-12(11)19/h1-7,19H |
InChIKey | MTMCXQDBTYMLQT-UHFFFAOYSA-N |
Molecular Weight | 409.139 g/mol |
SMILES | Oc1c(-c2oc(-c3cc(N(=O)=O)cc(c3)I)nn2)cccc1 |
SPLASH | splash10-05fr-7930300000-29e9c0b09616265129a3 |
Wiley ID | 1440734 |