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Urea, N-3-butynyl-N'-(4-chlorophenyl)-N-methyl-
SpectraBase Compound ID 5em2992JfNq
InChI InChI=1S/C12H13ClN2O/c1-3-4-9-15(2)12(16)14-11-7-5-10(13)6-8-11/h1,5-8H,4,9H2,2H3,(H,14,16)
InChIKey YXAIDEIOAVTHKF-UHFFFAOYSA-N
Mol Weight 236.7 g/mol
Molecular Formula C12H13ClN2O
Exact Mass 236.071641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4YZycg8lt6
Name Urea, N-3-butynyl-N'-(4-chlorophenyl)-N-methyl-
Alternate Name(s) N-(3-Butynyl)-N'-(4-chlorophenyl)-N-methylurea 1-But-3-ynyl-3-(4-chlorophenyl)-1-methyl-urea
CAS Registry Number 56247-81-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClN2O
InChI InChI=1S/C12H13ClN2O/c1-3-4-9-15(2)12(16)14-11-7-5-10(13)6-8-11/h1,5-8H,4,9H2,2H3,(H,14,16)
InChIKey YXAIDEIOAVTHKF-UHFFFAOYSA-N
Molecular Weight 236.702 g/mol
SMILES N(c1ccc(cc1)Cl)C(N(C)CCC#C)=O
SPLASH splash10-0udr-9430000000-e6e77bb89b4b3609314e
Source of Spectrum EP-8600-0-0
Wiley ID 1237838