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2-Iodo-4-nitro-1,3,5-triisobutylbenzene
SpectraBase Compound ID CALgfXtnTC2
InChI InChI=1S/C18H28INO2/c1-11(2)7-14-10-15(8-12(3)4)18(20(21)22)16(17(14)19)9-13(5)6/h10-13H,7-9H2,1-6H3
InChIKey ZXQZSTJXCSJNLR-UHFFFAOYSA-N
Mol Weight 417.33 g/mol
Molecular Formula C18H28INO2
Exact Mass 417.116474 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lXssTQHt15
Name 2-Iodo-4-nitro-1,3,5-triisobutylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28INO2
InChI InChI=1S/C18H28INO2/c1-11(2)7-14-10-15(8-12(3)4)18(20(21)22)16(17(14)19)9-13(5)6/h10-13H,7-9H2,1-6H3
InChIKey ZXQZSTJXCSJNLR-UHFFFAOYSA-N
Molecular Weight 417.331 g/mol
SMILES c1(c([N+]([O-])=O)c(CC(C)C)cc(c1I)CC(C)C)CC(C)C
SPLASH splash10-0pvi-0005900000-c10f40f06be74fb71969
Source of Spectrum S-35-487-0
Wiley ID 1376775