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Propanedioic acid, [(4-nitrophenyl)methylene]-, 1,1-dimethylethyl methyl ester, (Z)-
SpectraBase Compound ID IaBAlg80bwh
InChI InChI=1S/C15H17NO6/c1-15(2,3)22-14(18)12(13(17)21-4)9-10-5-7-11(8-6-10)16(19)20/h5-9H,1-4H3/b12-9-
InChIKey NQXKONQMVLRPSX-XFXZXTDPSA-N
Mol Weight 307.3 g/mol
Molecular Formula C15H17NO6
Exact Mass 307.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hs6H0Z1Sl1R
Name Propanedioic acid, [(4-nitrophenyl)methylene]-, 1,1-dimethylethyl methyl ester, (Z)-
CAS Registry Number 106098-19-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO6
InChI InChI=1S/C15H17NO6/c1-15(2,3)22-14(18)12(13(17)21-4)9-10-5-7-11(8-6-10)16(19)20/h5-9H,1-4H3/b12-9-
InChIKey NQXKONQMVLRPSX-XFXZXTDPSA-N
Molecular Weight 307.302 g/mol
SMILES C(\C(C(=O)OC)=C/c1ccc(N(=O)=O)cc1)(OC(C)(C)C)=O
SPLASH splash10-0fsi-0090000000-98f0193a18a4e0fc9a0e
Source of Spectrum J-51-4130-24
Synonyms 1-tert-Butyl 3-methyl (2Z)-2-(4-nitrobenzylidene)propanedioate tert-Butylmethyl (p-nitrobenzylidene)malonate-(Z)
Wiley ID 1308878