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Methyl N-(1,1-dimethylethyl)-4-nitrobenecarboximidate N-oxide
SpectraBase Compound ID IP0WC8zaXDj
InChI InChI=1S/C12H16N2O4/c1-12(2,3)13(15)11(18-4)9-5-7-10(8-6-9)14(16)17/h5-8H,1-4H3/b13-11-
InChIKey XPXVBLVJAMHMRU-QBFSEMIESA-N
Mol Weight 252.27 g/mol
Molecular Formula C12H16N2O4
Exact Mass 252.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KyhO2RdORwT
Name Methyl N-(1,1-dimethylethyl)-4-nitrobenecarboximidate N-oxide
Alternate Name(s) (Z)-tert-butyl[methoxy(4-nitrophenyl)methylene]azane oxide (Z)-[tert-butyl(oxido)imino](4-nitrophenyl)methyl methyl ether
CAS Registry Number 118891-56-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N2O4
InChI InChI=1S/C12H16N2O4/c1-12(2,3)13(15)11(18-4)9-5-7-10(8-6-9)14(16)17/h5-8H,1-4H3/b13-11-
InChIKey XPXVBLVJAMHMRU-QBFSEMIESA-N
Molecular Weight 252.270 g/mol
SMILES c1(\C(=[N+]/(C(C)(C)C)[O-])OC)ccc(N(=O)=O)cc1
SPLASH splash10-0zfr-8900000000-fbe21e2176761dafb9c2
Source of Spectrum J-54-1741-3
Wiley ID 1255224