| SpectraBase Spectrum ID |
BdbDnLRWgrs |
| Name |
3,5-Heptanedione, 2,2,6,6-tetramethyl-4-[(4-nitrophenyl)methyl]- |
| CAS Registry Number |
130745-76-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H25NO4 |
| InChI |
InChI=1S/C18H25NO4/c1-17(2,3)15(20)14(16(21)18(4,5)6)11-12-7-9-13(10-8-12)19(22)23/h7-10,14H,11H2,1-6H3 |
| InChIKey |
PTNJYHMVLXYRRW-UHFFFAOYSA-N |
| Molecular Weight |
319.401 g/mol |
| SMILES |
C(C(C(C)(C)C)=O)(C(C(C)(C)C)=O)Cc1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-0a4i-9000000000-50560107bf92a4d13f8a |
| Source of Spectrum |
F-46-5343-9 |
| Synonyms |
2,2,6,6-tetramethyl-4-(4-nitrobenzyl)-3,5-heptanedione
2,2,6,6-Tetramethyl-4-(4-nitrobenzyl)heptane-3,5-dione |
| Wiley ID |
1319399 |
![3,5-Heptanedione, 2,2,6,6-tetramethyl-4-[(4-nitrophenyl)methyl]-](/api/spectrum/BdbDnLRWgrs/structure.png?h=300&w=458 "3,5-Heptanedione, 2,2,6,6-tetramethyl-4-[(4-nitrophenyl)methyl]-")
