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3-Cyclohexyl-1-(2,2-dideuterio-2-chloroethyl)urea
SpectraBase Compound ID DbEjkZlQ5VX
InChI InChI=1S/C9H17ClN2O/c10-6-7-11-9(13)12-8-4-2-1-3-5-8/h8H,1-7H2,(H2,11,12,13)/i6D2
InChIKey BIOZXMXBLXQEBQ-NCYHJHSESA-N
Mol Weight 206.71 g/mol
Molecular Formula C9H152D2ClN2O
Exact Mass 206.115494 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJkR1fiqFeS
Name 3-Cyclohexyl-1-(2,2-dideuterio-2-chloroethyl)urea
CAS Registry Number 77081-33-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15D2ClN2O
InChI InChI=1S/C9H17ClN2O/c10-6-7-11-9(13)12-8-4-2-1-3-5-8/h8H,1-7H2,(H2,11,12,13)/i6D2
InChIKey BIOZXMXBLXQEBQ-NCYHJHSESA-N
Molecular Weight 206.713 g/mol
SMILES N(C(=O)NC1CCCCC1)CC(Cl)([2D])[2D]
SPLASH splash10-0a4i-9010000000-55efc149f998e8cc39e7
Source of Spectrum J-46-2487-0
Wiley ID 1201439