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1,3-Diazaadamantane, 6,6-dimethyl-5,7-dinitro-2-phenyl-
SpectraBase Compound ID K4sngdTxsXl
InChI InChI=1S/C16H20N4O4/c1-14(2)15(19(21)22)8-17-10-16(14,20(23)24)11-18(9-15)13(17)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3/t13-,15-,16+
InChIKey CQCUASFADUSHQL-MKZZRHPPSA-N
Mol Weight 332.36 g/mol
Molecular Formula C16H20N4O4
Exact Mass 332.148455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3cIbVn3kaPB
Name 1,3-Diazaadamantane, 6,6-dimethyl-5,7-dinitro-2-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N4O4
InChI InChI=1S/C16H20N4O4/c1-14(2)15(19(21)22)8-17-10-16(14,20(23)24)11-18(9-15)13(17)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3/t13-,15-,16+
InChIKey CQCUASFADUSHQL-MKZZRHPPSA-N
Molecular Weight 332.360 g/mol
SMILES CC1([C@]2(CN3C[C@@]1(CN(C2)C3c1ccccc1)N(=O)=O)N(=O)=O)C
SPLASH splash10-000f-9562000000-bbd08702ea76982f5cc1
Source of Spectrum AD-0-2532-0
Wiley ID 1427612