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3,3-Dimethyl-4-(N-(2-methylbenzyl)amino)-butan-2-one
SpectraBase Compound ID CJbnB8xxHSR
InChI InChI=1S/C14H21NO/c1-11-7-5-6-8-13(11)9-15-10-14(3,4)12(2)16/h5-8,15H,9-10H2,1-4H3
InChIKey ISLYIKNBGSMHLY-UHFFFAOYSA-N
Mol Weight 219.33 g/mol
Molecular Formula C14H21NO
Exact Mass 219.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BsSHGK3jdZ
Name 3,3-Dimethyl-4-(N-(2-methylbenzyl)amino)-butan-2-one
CAS Registry Number 119656-25-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO
InChI InChI=1S/C14H21NO/c1-11-7-5-6-8-13(11)9-15-10-14(3,4)12(2)16/h5-8,15H,9-10H2,1-4H3
InChIKey ISLYIKNBGSMHLY-UHFFFAOYSA-N
Molecular Weight 219.328 g/mol
SMILES N(CC(C(=O)C)(C)C)Cc1c(C)cccc1
SPLASH splash10-0a4i-6900000000-a55ce86dd57a105fbdd0
Source of Spectrum J-54-2590-13
Synonyms 3,3-Dimethyl-4-(o-tolylmethylamino)butan-2-one 3,3-Dimethyl-4-[(2-methylbenzyl)amino]-2-butanone 3,3-Dimethyl-4-[(2-methylbenzyl)amino]butan-2-one 3,3-Dimethyl-4-[(2-methylphenyl)methylamino]-2-butanone 3,3-Dimethyl-4-[(2-methylphenyl)methylamino]butan-2-one
Wiley ID 1219037