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5-Nitro-1,2,4-tri-tert-butylbenzene
SpectraBase Compound ID DcQC7Qv8puh
InChI InChI=1S/C18H29NO2/c1-16(2,3)12-10-14(18(7,8)9)15(19(20)21)11-13(12)17(4,5)6/h10-11H,1-9H3
InChIKey KBZCXGGKAWLPCH-UHFFFAOYSA-N
Mol Weight 291.44 g/mol
Molecular Formula C18H29NO2
Exact Mass 291.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ED1pSnebtWU
Name 5-Nitro-1,2,4-tri-tert-butylbenzene
Alternate Name(s) 1,2,4-tritert-butyl-5-nitrobenzene
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Formula C18H29NO2
InChI InChI=1S/C18H29NO2/c1-16(2,3)12-10-14(18(7,8)9)15(19(20)21)11-13(12)17(4,5)6/h10-11H,1-9H3
InChIKey KBZCXGGKAWLPCH-UHFFFAOYSA-N
Molecular Weight 291.435 g/mol
SMILES c1(N(=O)=O)c(cc(c(c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
SPLASH splash10-0a6r-6090000000-e5b3f8feb16254441705
Source of Spectrum V2-18-1-0
Wiley ID 1294719