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(E,Z)-2-(But-1-enyl)-6-chloronitrobenzene
SpectraBase Compound ID HMSj2gVQijk
InChI InChI=1S/C10H10ClNO2/c1-2-3-5-8-6-4-7-9(11)10(8)12(13)14/h3-7H,2H2,1H3
InChIKey ICLCWADNKCMOGO-UHFFFAOYSA-N
Mol Weight 211.65 g/mol
Molecular Formula C10H10ClNO2
Exact Mass 211.040006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICc4YJuYO24
Name (E,Z)-2-(But-1-enyl)-6-chloronitrobenzene
Appearance Pale yellow oil
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Exact Mass 211.040006264 u
Formula C10H10ClNO2
InChI InChI=1S/C10H10ClNO2/c1-2-3-5-8-6-4-7-9(11)10(8)12(13)14/h3-7H,2H2,1H3
InChIKey ICLCWADNKCMOGO-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801018
Molecular Weight 211.648 g/mol
Quality 514
Reported Formula C10H10ClNO2
SMILES [N+]([O-])(=O)C1=C(C=CC=C1C=CCC)Cl
SPLASH splash10-05r3-7900000000-c297bf07e208448a4bcb
Sample Comments Z/E = 3.7:1
Source of Spectrum K1-2018-6653-7b (DOI: 10.1002/ejoc.201801018)
Wiley ID 1896966