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1,1'-Biphenyl, 4-methyl-2-(1-methylethoxy)-2',6'-dinitro-
SpectraBase Compound ID 79yAHW7PY6k
InChI InChI=1S/C16H16N2O5/c1-10(2)23-15-9-11(3)7-8-12(15)16-13(17(19)20)5-4-6-14(16)18(21)22/h4-10H,1-3H3
InChIKey TWPNIYPPVRHVAH-UHFFFAOYSA-N
Mol Weight 316.31 g/mol
Molecular Formula C16H16N2O5
Exact Mass 316.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDbsj2uqpkb
Name 1,1'-Biphenyl, 4-methyl-2-(1-methylethoxy)-2',6'-dinitro-
Alternate Name(s) 2'-Isopropoxy-4'-methyl-2,6-dinitrobiphenyl 2-isopropoxy-4-methyl-2',6'-dinitro-1,1'-biphenyl isopropyl 4-methyl-2',6'-dinitro[1,1'-biphenyl]-2-yl ether
CAS Registry Number 111220-36-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2O5
InChI InChI=1S/C16H16N2O5/c1-10(2)23-15-9-11(3)7-8-12(15)16-13(17(19)20)5-4-6-14(16)18(21)22/h4-10H,1-3H3
InChIKey TWPNIYPPVRHVAH-UHFFFAOYSA-N
Molecular Weight 316.313 g/mol
SMILES c1(-c2c(OC(C)C)cc(cc2)C)c(N(=O)=O)cccc1N(=O)=O
SPLASH splash10-00xr-0093000000-7518f6d3c7cb908b0d4c
Source of Spectrum KC-1987-862-7
Wiley ID 1316585