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1-BUTYL-3-(3,4-DICHLOROPHENYL)-1-METHYLUREA
SpectraBase Compound ID 20bTaHXS9Ar
InChI InChI=1S/C12H16Cl2N2O/c1-3-4-7-16(2)12(17)15-9-5-6-10(13)11(14)8-9/h5-6,8H,3-4,7H2,1-2H3,(H,15,17)
InChIKey CCGPUGMWYLICGL-UHFFFAOYSA-N
Mol Weight 275.18 g/mol
Molecular Formula C12H16Cl2N2O
Exact Mass 274.063969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KeCk6FuhI4
Name NEBURONE 2
CAS Registry Number 555-37-3
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 274.063968542 u
Formula C12H16Cl2N2O
InChI InChI=1S/C12H16Cl2N2O/c1-3-4-7-16(2)12(17)15-9-5-6-10(13)11(14)8-9/h5-6,8H,3-4,7H2,1-2H3,(H,15,17)
InChIKey CCGPUGMWYLICGL-UHFFFAOYSA-N
Molecular Weight 275.179 g/mol
Nominal Mass 274 u
Number of Peaks 87
SMILES N(c1ccc(c(c1)Cl)Cl)C(N(C)CCCC)=O
SPLASH splash10-0a4l-9410000000-bd98f26d673c8411a3ad
Source of Spectrum Dr. Rolf Kuehnle
Synonyms N-butyl-N'-(3,4-dichlorophenyl)-N-methylurea
Technique GC/MS
Wiley ID WID_MSPA_3436