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1-Methyl-4-[(1Z)-2-nitro-1-propenyl]benzene
SpectraBase Compound ID 28r5g447m1b
InChI InChI=1S/C10H11NO2/c1-8-3-5-10(6-4-8)7-9(2)11(12)13/h3-7H,1-2H3/b9-7-
InChIKey JEKFDNFWPBWEKO-CLFYSBASSA-N
Mol Weight 177.2 g/mol
Molecular Formula C10H11NO2
Exact Mass 177.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8bFAS6dtI5
Name 1-Methyl-4-[(1Z)-2-nitro-1-propenyl]benzene
Alternate Name(s) 1-Methyl-4-[(Z)-2-nitroprop-1-enyl]benzene 4-Methyl-.beta.-methyl-.beta.-nitrostyrene trans-4-Methyl-.beta.-methyl-.beta.-nitrostyrene
CAS Registry Number 52287-56-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO2
InChI InChI=1S/C10H11NO2/c1-8-3-5-10(6-4-8)7-9(2)11(12)13/h3-7H,1-2H3/b9-7-
InChIKey JEKFDNFWPBWEKO-CLFYSBASSA-N
Molecular Weight 177.203 g/mol
SMILES c1cc(ccc1\C=C\(C)N(=O)=O)C
SPLASH splash10-03xr-4900000000-579322b1b1749724d2fb
Source of Spectrum RB-1982-13491-0
Wiley ID 1173121