| SpectraBase Spectrum ID |
CDpUSqcNhlS |
| Name |
1,1-bis(2,4-dihydroxy-3-nitrophenyl)ethane |
| Alternate Name(s) |
4-[1-(2,4-dihydroxy-3-nitrophenyl)ethyl]-2-nitro-1,3-benzenediol |
| CAS Registry Number |
118600-25-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H12N2O8 |
| InChI |
InChI=1S/C14H12N2O8/c1-6(7-2-4-9(17)11(13(7)19)15(21)22)8-3-5-10(18)12(14(8)20)16(23)24/h2-6,17-20H,1H3 |
| InChIKey |
CDOMEBMVTMAZLN-UHFFFAOYSA-N |
| Molecular Weight |
336.256 g/mol |
| SMILES |
Oc1c(c(c(C(c2ccc(c(c2O)N(=O)=O)O)C)cc1)O)N(=O)=O |
| SPLASH |
splash10-00dr-0009000000-6bb148a87d3d2857a1b7 |
| Source of Spectrum |
J-54-1311-21 |
| Wiley ID |
1332064 |
