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5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cycloheptane]
SpectraBase Compound ID KXwXr0Wg2LM
InChI InChI=1S/C13H14N2O6/c16-14(17)9-7-11-12(8-10(9)15(18)19)21-13(20-11)5-3-1-2-4-6-13/h7-8H,1-6H2
InChIKey AUFGFCDIWFJIOO-UHFFFAOYSA-N
Mol Weight 294.26 g/mol
Molecular Formula C13H14N2O6
Exact Mass 294.085186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKOzKmBz5c7
Name 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cycloheptane]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O6
InChI InChI=1S/C13H14N2O6/c16-14(17)9-7-11-12(8-10(9)15(18)19)21-13(20-11)5-3-1-2-4-6-13/h7-8H,1-6H2
InChIKey AUFGFCDIWFJIOO-UHFFFAOYSA-N
Molecular Weight 294.263 g/mol
SMILES c1(c(N(=O)=O)cc2c(c1)OC1(CCCCCC1)O2)N(=O)=O
SPLASH splash10-00kg-9030000000-fb3e0664ff8b920145dd
Source of Spectrum Y-29-125-12
Wiley ID 1296818