| SpectraBase Spectrum ID |
KT4hzPBUHeA |
| Name |
Butanedioic acid, [2-(2-bromo-5-nitrophenyl)-2-butenylidene]-, 4-(1,1-dimethylethyl) 1-methyl ester, (E,Z)- |
| CAS Registry Number |
121742-96-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H22BrNO6 |
| InChI |
InChI=1S/C19H22BrNO6/c1-6-12(15-11-14(21(24)25)7-8-16(15)20)9-13(18(23)26-5)10-17(22)27-19(2,3)4/h6-9,11H,10H2,1-5H3/b12-6+,13-9- |
| InChIKey |
GJAXIGNTMPXMRJ-AAVBEOHCSA-N |
| Molecular Weight |
440.290 g/mol |
| SMILES |
c1(N(=O)=O)cc(\C(\C=C/(C(=O)OC)CC(OC(C)(C)C)=O)=C\C)c(cc1)Br |
| SPLASH |
splash10-001i-0009300000-2802849561bcaddd4d95 |
| Source of Spectrum |
F-45-251-8 |
| Synonyms |
4-tert-butyl 1-methyl (2Z)-2-[(2E)-2-(2-bromo-5-nitrophenyl)-2-butenylidene]butanedioate
t-butyl 5-(2-bromo-5-nitrophenyl)-3-methoxycarbonylhepta-3,5-dienoate |
| Wiley ID |
1384379 |
![Butanedioic acid, [2-(2-bromo-5-nitrophenyl)-2-butenylidene]-, 4-(1,1-dimethylethyl) 1-methyl ester, (E,Z)-](/api/spectrum/KT4hzPBUHeA/structure.png?h=300&w=458 "Butanedioic acid, [2-(2-bromo-5-nitrophenyl)-2-butenylidene]-, 4-(1,1-dimethylethyl) 1-methyl ester, (E,Z)-")
