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2,4-dinitro-6-isopropylphenol
SpectraBase Compound ID 75LY5A1Jqc2
InChI InChI=1S/C9H10N2O5/c1-5(2)7-3-6(10(13)14)4-8(9(7)12)11(15)16/h3-5,12H,1-2H3
InChIKey HBYHYLBZPLCIEE-UHFFFAOYSA-N
Mol Weight 226.19 g/mol
Molecular Formula C9H10N2O5
Exact Mass 226.058971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcCoZBEW04u
Name Phenol, (1-methylethyl)dinitro-
Alternate Name(s) 2-Isopropyl-4,6-dinitrophenol 2,4-Dinitro-6-isopropylphenol 2,4-Dinitro-6-propan-2-yl-phenol 2,4-Dinitro-6-propan-2-ylphenol EINECS 249-592-4
CAS Registry Number 29385-11-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10N2O5
InChI InChI=1S/C9H10N2O5/c1-5(2)7-3-6(10(13)14)4-8(9(7)12)11(15)16/h3-5,12H,1-2H3
InChIKey HBYHYLBZPLCIEE-UHFFFAOYSA-N
Molecular Weight 226.188 g/mol
SMILES Oc1c(C(C)C)cc(cc1N(=O)=O)N(=O)=O
SPLASH splash10-03di-9520000000-fe29158ad0036f7abd89
Source of Spectrum W5-19247-0-0
Wiley ID 1226822