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tert-Butyl ester of (E)-3,4-Dimethyl-5-(2-nitrovinyl)-pyrrol-2-carboxylic acid
SpectraBase Compound ID 5jAidU3RjZP
InChI InChI=1S/C13H18N2O4/c1-8-9(2)11(12(16)19-13(3,4)5)14-10(8)6-7-15(17)18/h6-7,14H,1-5H3/b7-6+
InChIKey LFPZNLLFWITLPJ-VOTSOKGWSA-N
Mol Weight 266.3 g/mol
Molecular Formula C13H18N2O4
Exact Mass 266.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HpNWIzCoF6b
Name tert-Butyl ester of (E)-3,4-Dimethyl-5-(2-nitrovinyl)-pyrrol-2-carboxylic acid
Alternate Name(s) tert-Butyl 3,4-dimethyl-5-[(E)-2-nitroethenyl]-1H-pyrrole-2-carboxylate
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Formula C13H18N2O4
InChI InChI=1S/C13H18N2O4/c1-8-9(2)11(12(16)19-13(3,4)5)14-10(8)6-7-15(17)18/h6-7,14H,1-5H3/b7-6+
InChIKey LFPZNLLFWITLPJ-VOTSOKGWSA-N
Molecular Weight 266.297 g/mol
SMILES [nH]1c(c(c(c1C(OC(C)(C)C)=O)C)C)\C=C\N(=O)=O
SPLASH splash10-01ot-0920000000-12bb7b31645cc8b93ae8
Source of Spectrum AH-113-1345-0
Wiley ID 1269720