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Benzene, (3-methyl-1-nitro-1-butenyl)-, (E)-
SpectraBase Compound ID 873JfqadHAU
InChI InChI=1S/C11H13NO2/c1-9(2)8-11(12(13)14)10-6-4-3-5-7-10/h3-9H,1-2H3/b11-8+
InChIKey PEFQFDMTYZJJFT-DHZHZOJOSA-N
Mol Weight 191.23 g/mol
Molecular Formula C11H13NO2
Exact Mass 191.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38hIaQwdzxN
Name Benzene, (3-methyl-1-nitro-1-butenyl)-, (E)-
Alternate Name(s) (E)-3-Methyl-1-nitro-1-phenylbut-1-ene [(1E)-3-methyl-1-nitro-1-butenyl]benzene [(E)-3-methyl-1-nitrobut-1-enyl]benzene
CAS Registry Number 104461-21-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO2
InChI InChI=1S/C11H13NO2/c1-9(2)8-11(12(13)14)10-6-4-3-5-7-10/h3-9H,1-2H3/b11-8+
InChIKey PEFQFDMTYZJJFT-DHZHZOJOSA-N
Molecular Weight 191.230 g/mol
SMILES C(\C=C/(N(=O)=O)c1ccccc1)(C)C
SPLASH splash10-0007-5900000000-9319dfd38e1e8cdf4b7f
Source of Spectrum B-38-1514-15
Wiley ID 1187517