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(S) N-Methyl-N-[1-(N''-(3,5-dimethylphenyl)carbamyl)-2-methylpropyl]-N'-phenylurea
SpectraBase Compound ID L23wUJeUYPW
InChI InChI=1S/C21H27N3O2/c1-14(2)19(20(25)22-18-12-15(3)11-16(4)13-18)24(5)21(26)23-17-9-7-6-8-10-17/h6-14,19H,1-5H3,(H,22,25)(H,23,26)/t19-/m0/s1
InChIKey ZLIZYQHTWOYPMX-IBGZPJMESA-N
Mol Weight 353.47 g/mol
Molecular Formula C21H27N3O2
Exact Mass 353.210327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83nEUWgxrIc
Name (S) N-Methyl-N-[1-(N''-(3,5-dimethylphenyl)carbamyl)-2-methylpropyl]-N'-phenylurea
Alternate Name(s) (2S)-2-[(anilinocarbonyl)(methyl)amino]-N-(3,5-dimethylphenyl)-3-methylbutanamide N-Methyl-N-[1-(N''-(3,5-dimethylphenyl)carbamyl)-2-methylpropyl]-N'-phenylurea
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Formula C21H27N3O2
InChI InChI=1S/C21H27N3O2/c1-14(2)19(20(25)22-18-12-15(3)11-16(4)13-18)24(5)21(26)23-17-9-7-6-8-10-17/h6-14,19H,1-5H3,(H,22,25)(H,23,26)/t19-/m0/s1
InChIKey ZLIZYQHTWOYPMX-IBGZPJMESA-N
Molecular Weight 353.466 g/mol
SMILES N(C([C@@](N(C(Nc1ccccc1)=O)C)(C(C)C)[H])=O)c1cc(C)cc(c1)C
SPLASH splash10-0019-9330000000-d0883099f84b67d2b61b
Source of Spectrum F-62-278-11
Wiley ID 1631822