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2,6-Dinitro-9,10-dihydro-9,10-ethanoanthracene-9-carbonitrile
SpectraBase Compound ID 1mtU3KBfKyH
InChI InChI=1S/C17H11N3O4/c18-9-17-6-5-12(13-3-1-11(20(23)24)8-16(13)17)14-7-10(19(21)22)2-4-15(14)17/h1-4,7-8,12H,5-6H2
InChIKey OIZYOOQKTSUHPN-UHFFFAOYSA-N
Mol Weight 321.29 g/mol
Molecular Formula C17H11N3O4
Exact Mass 321.074956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0giCdSG6hU
Name 2,6-Dinitro-9,10-dihydro-9,10-ethanoanthracene-9-carbonitrile
Alternate Name(s) 4,11-dinitrotetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13-hexaene-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11N3O4
InChI InChI=1S/C17H11N3O4/c18-9-17-6-5-12(13-3-1-11(20(23)24)8-16(13)17)14-7-10(19(21)22)2-4-15(14)17/h1-4,7-8,12H,5-6H2
InChIKey OIZYOOQKTSUHPN-UHFFFAOYSA-N
Molecular Weight 321.292 g/mol
SMILES C12(c3c(ccc(N(=O)=O)c3)C(CC1)c1c2ccc(N(=O)=O)c1)C#N
SPLASH splash10-0006-0190000000-a8cb8419720b38b9227f
Source of Spectrum B-48-1949-0
Wiley ID 1320869