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1-(2-Chlorophenyl)-2-nitroprop-1-ene
SpectraBase Compound ID 8oQ2RoW34wb
InChI InChI=1S/C9H8ClNO2/c1-7(11(12)13)6-8-4-2-3-5-9(8)10/h2-6H,1H3/b7-6-
InChIKey FCXHCITVQOIVMI-SREVYHEPSA-N
Mol Weight 197.62 g/mol
Molecular Formula C9H8ClNO2
Exact Mass 197.024356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GLnrCQzxjs
Name 1-(2-Chlorophenyl)-2-nitroprop-1-ene
CAS Registry Number 18982-43-9
Classification Designer drug precursor
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 197.024356200 u
Formula C9H8ClNO2
InChI InChI=1S/C9H8ClNO2/c1-7(11(12)13)6-8-4-2-3-5-9(8)10/h2-6H,1H3/b7-6-
InChIKey FCXHCITVQOIVMI-SREVYHEPSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 197.621 g/mol
Nominal Mass 197 u
Quality 981
Retention Index 1440
SMILES C1(=C(C=CC=C1)Cl)\C=C\([N+](=O)[O-])C
SPLASH splash10-014i-3900000000-cbd3c4472f8cc8ff47d4
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-Chloro-2-(2-nitro-1-propen-1-yl)benzene
Technique GC/MS
Wiley ID DD2024_000593