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5,7-Dinitro-1,3-diazaadamantane
SpectraBase Compound ID 8ESyidFDp7j
InChI InChI=1S/C8H12N4O4/c13-11(14)7-1-8(12(15)16)4-9(2-7)6-10(3-7)5-8/h1-6H2/t7-,8+
InChIKey PEAVOCFYRIZZJU-OCAPTIKFSA-N
Mol Weight 228.21 g/mol
Molecular Formula C8H12N4O4
Exact Mass 228.085855 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8epcrGxALP8
Name 5,7-Dinitro-1,3-diazaadamantane
CAS Registry Number 42212-82-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12N4O4
InChI InChI=1S/C8H12N4O4/c13-11(14)7-1-8(12(15)16)4-9(2-7)6-10(3-7)5-8/h1-6H2/t7-,8+
InChIKey PEAVOCFYRIZZJU-OCAPTIKFSA-N
Molecular Weight 228.208 g/mol
SMILES [C@]12(N(=O)=O)C[C@@]3(N(=O)=O)CN(C2)CN(C1)C3
SPLASH splash10-055o-9710000000-9a7b5059635c42e2d71e
Source of Spectrum AD-0-2532-0
Synonyms 1,3-Diazadamantane, 5,7-dinitro-
Wiley ID 1430485