3-[p-(t-Butyl)]-3-nitropropyl Methyl Ketone

SpectraBase Compound ID	2fITl4LnzZ3
InChI	InChI=1S/C15H21NO3/c1-11(17)5-10-14(16(18)19)12-6-8-13(9-7-12)15(2,3)4/h6-9,14H,5,10H2,1-4H3
InChIKey	SVVQMLQROPDECY-UHFFFAOYSA-N Google Search
Mol Weight	263.34 g/mol
Molecular Formula	C15H21NO3
Exact Mass	263.152144 g/mol

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SpectraBase Spectrum ID	1mr00Iv4ATF
Name	3-[p-(t-Butyl)]-3-nitropropyl Methyl Ketone
Alternate Name(s)	5-(4-(tert-butyl)phenyl)-5-nitropentan-2-one 5-(4-tert-butylphenyl)-5-nitro-2-pentanone 5-(4-tert-butylphenyl)-5-nitropentan-2-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H21NO3
InChI	InChI=1S/C15H21NO3/c1-11(17)5-10-14(16(18)19)12-6-8-13(9-7-12)15(2,3)4/h6-9,14H,5,10H2,1-4H3
InChIKey	SVVQMLQROPDECY-UHFFFAOYSA-N
Molecular Weight	263.337 g/mol
SMILES	C(N(=O)=O)(CCC(=O)C)c1ccc(C(C)(C)C)cc1
SPLASH	splash10-0apl-5490000000-64180f837ac4f8e6fef3
Source of Spectrum	F5-3-2993-5
Wiley ID	1732413