| SpectraBase Spectrum ID |
IqjjqD5eQV6 |
| Name |
2(1H)-Pyrimidinone, tetrahydro-1,3-bis(2-hydroxy-3-nitrophenyl)- |
| Alternate Name(s) |
1,3-bis(2-hydroxy-3-nitrophenyl)tetrahydro-2(1H)-pyrimidinone
1,3-bis(2-hydroxy-3-nitrophenyl)tetrahydro-2-pyrimidinone |
| CAS Registry Number |
107913-49-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14N4O7 |
| InChI |
InChI=1S/C16H14N4O7/c21-14-10(4-1-6-12(14)19(24)25)17-8-3-9-18(16(17)23)11-5-2-7-13(15(11)22)20(26)27/h1-2,4-7,21-22H,3,8-9H2 |
| InChIKey |
KKGPDYYOBOQIMW-UHFFFAOYSA-N |
| Molecular Weight |
374.309 g/mol |
| SMILES |
Oc1c(N2C(N(c3cccc(c3O)N(=O)=O)CCC2)=O)cccc1N(=O)=O |
| SPLASH |
splash10-00xr-0409000000-bbb2b605b20ba273d849 |
| Source of Spectrum |
C-109-3104-12 |
| Wiley ID |
1356379 |
