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alpha-CHLORO-p-NITROTOLUENE
SpectraBase Compound ID AUjcSUyBF1D
InChI InChI=1S/C7H6ClNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2
InChIKey KGCNHWXDPDPSBV-UHFFFAOYSA-N
Mol Weight 171.58 g/mol
Molecular Formula C7H6ClNO2
Exact Mass 171.008706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CBX6YJaD2C
Name 1-(chloromethyl)-4-nitrobenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 171.008706135 u
Formula C7H6ClNO2
InChI InChI=1S/C7H6ClNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2
InChIKey KGCNHWXDPDPSBV-UHFFFAOYSA-N
Instrument Name Thermo Scientific ISQ QD
Ionization Type EI
Literature Reference DOI 10.1002/chem.201501439
Quality 1000
SMILES C=1(C=CC(=CC1)[N+]([O-])=O)CCl
SPLASH splash10-01pa-9100000000-9c79c08189f73bb82af4
Source of Spectrum QE-21-SM13-13-2 (DOI: 10.1002/chem.201501439)
Wiley ID 1909126