For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Propanedioic acid, [bromo(4-nitrophenyl)methylene]-, 1,1-dimethylethyl methyl ester, (E)-
SpectraBase Compound ID 5PwgQsrWfOD
InChI InChI=1S/C15H16BrNO6/c1-15(2,3)23-14(19)11(13(18)22-4)12(16)9-5-7-10(8-6-9)17(20)21/h5-8H,1-4H3/b12-11+
InChIKey IAYBJZPNCAHRGI-VAWYXSNFSA-N
Mol Weight 386.2 g/mol
Molecular Formula C15H16BrNO6
Exact Mass 385.0161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HrvcOoXdDpA
Name Propanedioic acid, [bromo(4-nitrophenyl)methylene]-, 1,1-dimethylethyl methyl ester, (E)-
CAS Registry Number 106098-06-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16BrNO6
InChI InChI=1S/C15H16BrNO6/c1-15(2,3)23-14(19)11(13(18)22-4)12(16)9-5-7-10(8-6-9)17(20)21/h5-8H,1-4H3/b12-11+
InChIKey IAYBJZPNCAHRGI-VAWYXSNFSA-N
Molecular Weight 386.198 g/mol
SMILES C(\C(=C/(c1ccc(N(=O)=O)cc1)Br)C(=O)OC)(OC(C)(C)C)=O
SPLASH splash10-05di-0759000000-4e17dc8ed1ee34c9581b
Source of Spectrum J-51-4130-0
Synonyms 1-tert-Butyl 3-methyl (2E)-2-[bromo(4-nitrophenyl)methylene]propanedioate tert-Butyl methyl .beta.-bromo(p-nitrobenzylidene)-malonates-(E)
Wiley ID 1362081