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3-Cyclohexyl-1-(1,1-dideuterio-2-chloroethyl)urea
SpectraBase Compound ID 9w9Vk19YsEH
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)/i7D2
InChIKey BIOZXMXBLXQEBQ-RJSZUWSASA-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 HBFRhpR7B10
Name 3-Cyclohexyl-1-(1,1-dideuterio-2-chloroethyl)urea
CAS Registry Number 77081-26-6
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)/i7D2
InChIKey BIOZXMXBLXQEBQ-RJSZUWSASA-N
Molecular Weight 206.713 g/mol
SMILES N(C(=O)NC1CCCCC1)C(CCl)([2D])[2D]
SPLASH splash10-0a4i-9000000000-938b1fd25662cb8fad23
Source of Spectrum J-46-2486-0
Wiley ID 1201438