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2-Iodo-4-nitro-1,3,5-trineopentyl-benzene
SpectraBase Compound ID 4DPDBcVBR82
InChI InChI=1S/C21H34INO2/c1-19(2,3)11-14-10-15(12-20(4,5)6)18(23(24)25)16(17(14)22)13-21(7,8)9/h10H,11-13H2,1-9H3
InChIKey VZUQUUDIOKJMNL-UHFFFAOYSA-N
Mol Weight 459.4 g/mol
Molecular Formula C21H34INO2
Exact Mass 459.163424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfRxLJZeDuO
Name Benzene, 1,3,5-tris(2,2-dimethylpropyl)-2-iodo-4-nitro-
CAS Registry Number 41080-95-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34INO2
InChI InChI=1S/C21H34INO2/c1-19(2,3)11-14-10-15(12-20(4,5)6)18(23(24)25)16(17(14)22)13-21(7,8)9/h10H,11-13H2,1-9H3
InChIKey VZUQUUDIOKJMNL-UHFFFAOYSA-N
Molecular Weight 459.412 g/mol
SMILES CC(C)(C)Cc1cc(CC(C)(C)C)c(c(CC(C)(C)C)c1N(=O)=O)I
SPLASH splash10-0a4i-9005200000-0df040007877d8243d46
Source of Spectrum EP-6524-0-0
Synonyms 2-Iodo-1,3,5-trineopentyl-4-nitrobenzene 1,3,5-tris(2,2-dimethylpropyl)-2-iodanyl-4-nitro-benzene 1,3,5-tris(2,2-dimethylpropyl)-2-iodo-4-nitro-benzene 1,3,5-tris(2,2-dimethylpropyl)-2-iodo-4-nitrobenzene
Wiley ID 1390182