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2,8-Dinitro-6,12-epoxy-6H,12H-dibenzo[b,f][1,5]dioxocin
SpectraBase Compound ID 3kCMsJci1zm
InChI InChI=1S/C14H8N2O7/c17-15(18)7-1-3-11-9(5-7)13-22-12-4-2-8(16(19)20)6-10(12)14(21-11)23-13/h1-6,13-14H/t13-,14-/m1/s1
InChIKey YFMCMVDWQUUBRX-ZIAGYGMSSA-N
Mol Weight 316.23 g/mol
Molecular Formula C14H8N2O7
Exact Mass 316.033151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dx8AsKkH92B
Name 2,8-Dinitro-6,12-epoxy-6H,12H-dibenzo[b,f][1,5]dioxocin
Alternate Name(s) 4,12-dinitro-8,16,17-trioxatetracyclo[7.7.1.0(2,7).0(10,15)]heptadeca-2,4,6,10,12,14-hexaene
CAS Registry Number 75625-89-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8N2O7
InChI InChI=1S/C14H8N2O7/c17-15(18)7-1-3-11-9(5-7)13-22-12-4-2-8(16(19)20)6-10(12)14(21-11)23-13/h1-6,13-14H/t13-,14-/m1/s1
InChIKey YFMCMVDWQUUBRX-ZIAGYGMSSA-N
Molecular Weight 316.225 g/mol
SMILES [C@@]12(c3c(ccc(N(=O)=O)c3)O[C@](O1)(c1c(O2)ccc(N(=O)=O)c1)[H])[H]
SPLASH splash10-05ur-9521000000-4dc1088f1088e8760791
Source of Spectrum J-46-196-0
Wiley ID 1316421