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2,4,6-TRIMETHYL-TRANS-BETA-METHYL-BETA-NITROSTYRENE
SpectraBase Compound ID 5Z3UYrSaJdQ
InChI InChI=1S/C12H15NO2/c1-8-5-9(2)12(10(3)6-8)7-11(4)13(14)15/h5-7H,1-4H3/b11-7+
InChIKey CILKZWLODIJOFN-YRNVUSSQSA-N
Mol Weight 205.26 g/mol
Molecular Formula C12H15NO2
Exact Mass 205.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3OiCHjJesGl
Name 1,3,5-Trimethyl-2-[(1Z)-2-nitro-1-propenyl]benzene
Alternate Name(s) 1,3,5-trimethyl-2-[(E)-2-nitroprop-1-enyl]benzene trans-2,4,6-Trimethyl-.beta.-methyl-.beta.-nitrostyrene
CAS Registry Number 147102-62-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO2
InChI InChI=1S/C12H15NO2/c1-8-5-9(2)12(10(3)6-8)7-11(4)13(14)15/h5-7H,1-4H3/b11-7+
InChIKey CILKZWLODIJOFN-YRNVUSSQSA-N
Molecular Weight 205.257 g/mol
SMILES Cc1cc(C)c(\C=C/(C)N(=O)=O)c(C)c1
SPLASH splash10-054o-2900000000-593fffb4857df2ebbf9a
Source of Spectrum JZ-1992-4949-0
Wiley ID 1203428