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2-Nitro-1,3,5-trineopentyl-benzene
SpectraBase Compound ID LhH1D3CT97T
InChI InChI=1S/C21H35NO2/c1-19(2,3)12-15-10-16(13-20(4,5)6)18(22(23)24)17(11-15)14-21(7,8)9/h10-11H,12-14H2,1-9H3
InChIKey ACWSHQYPMFHBQV-UHFFFAOYSA-N
Mol Weight 333.5 g/mol
Molecular Formula C21H35NO2
Exact Mass 333.266779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UcZ4684NM2
Name Benzene, 1,3,5-tris(2,2-dimethylpropyl)-2-nitro-
CAS Registry Number 40572-19-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H35NO2
InChI InChI=1S/C21H35NO2/c1-19(2,3)12-15-10-16(13-20(4,5)6)18(22(23)24)17(11-15)14-21(7,8)9/h10-11H,12-14H2,1-9H3
InChIKey ACWSHQYPMFHBQV-UHFFFAOYSA-N
Molecular Weight 333.516 g/mol
SMILES CC(C)(C)Cc1cc(CC(C)(C)C)c(c(c1)CC(C)(C)C)N(=O)=O
SPLASH splash10-0bt9-8091000000-f1d4c45febaa7e68e4af
Source of Spectrum EP-6525-0-0
Synonyms 1,3,5-trineopentyl-2-nitro-benzene 1,3,5-tris(2,2-dimethylpropyl)-2-nitro-benzene
Wiley ID 1330404