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1-(2,4-Dinitrophenyl)adamantane
SpectraBase Compound ID HQqvU0VOKx7
InChI InChI=1S/C16H18N2O4/c19-17(20)13-1-2-14(15(6-13)18(21)22)16-7-10-3-11(8-16)5-12(4-10)9-16/h1-2,6,10-12H,3-5,7-9H2/t10-,11+,12-,16-
InChIKey IOGYRPLYACDOIV-BZQOWKENSA-N
Mol Weight 302.33 g/mol
Molecular Formula C16H18N2O4
Exact Mass 302.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hRm9dOSELr
Name 1-(2,4-Dinitrophenyl)adamantane
Alternate Name(s) Tricyclo[3.3.1.1(3,7)]decane, 1-(2,4-dinitrophenyl)-
CAS Registry Number 71466-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O4
InChI InChI=1S/C16H18N2O4/c19-17(20)13-1-2-14(15(6-13)18(21)22)16-7-10-3-11(8-16)5-12(4-10)9-16/h1-2,6,10-12H,3-5,7-9H2/t10-,11+,12-,16-
InChIKey IOGYRPLYACDOIV-BZQOWKENSA-N
Molecular Weight 302.330 g/mol
SMILES c1cc(c(cc1N(=O)=O)N(=O)=O)C12C[C@]3(C[C@](C[C@](C3)(C1)[H])(C2)[H])[H]
SPLASH splash10-00oc-7590000000-b758cda86a0710724917
Source of Spectrum KC-1979-472-0
Wiley ID 1304548