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1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindole-2-carbonitrile
SpectraBase Compound ID Jl5nNaFstjW
InChI InChI=1S/C9H8N2O2/c10-5-11-8(12)6-3-1-2-4-7(6)9(11)13/h1-2,6-7H,3-4H2
InChIKey LVWBPDALRPYQBI-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C9H8N2O2
Exact Mass 176.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rnwDuPXGxA
Name 1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindole-2-carbonitrile
Alternate Name(s) 1,3-Diketo-3a,4,7,7a-tetrahydroisoindole-2-carbonitrile 1,3-Dioxo-3a,4,7,7a-tetrahydroisoindole-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2O2
InChI InChI=1S/C9H8N2O2/c10-5-11-8(12)6-3-1-2-4-7(6)9(11)13/h1-2,6-7H,3-4H2
InChIKey LVWBPDALRPYQBI-UHFFFAOYSA-N
Molecular Weight 176.175 g/mol
SMILES C1(N(C(C2CC=CCC12)=O)C#N)=O
SPLASH splash10-004i-9400000000-aa9b258d655c4cc4a4e4
Source of Spectrum SK-21-2031-6
Wiley ID 851909