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1,2-Dihydro-3-ethyl-2-methyl-1,2,4,5-tetrazino[6,1-a]isoindol-6(10bH)-one
SpectraBase Compound ID 35K22QzQ7yT
InChI InChI=1S/C12H14N4O/c1-3-10-13-16-11(14-15(10)2)8-6-4-5-7-9(8)12(16)17/h4-7,11,14H,3H2,1-2H3
InChIKey PDSMRQNJDHRIEV-UHFFFAOYSA-N
Mol Weight 230.27 g/mol
Molecular Formula C12H14N4O
Exact Mass 230.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2NfTscuuUy
Name 1,2-Dihydro-3-ethyl-2-methyl-1,2,4,5-tetrazino[6,1-a]isoindol-6(10bH)-one
Alternate Name(s) 3-ethyl-2-methyl-1,10b-dihydro[1,2,4,5]tetraazino[6,1-a]isoindol-6(2H)-one
CAS Registry Number 137257-30-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N4O
InChI InChI=1S/C12H14N4O/c1-3-10-13-16-11(14-15(10)2)8-6-4-5-7-9(8)12(16)17/h4-7,11,14H,3H2,1-2H3
InChIKey PDSMRQNJDHRIEV-UHFFFAOYSA-N
Molecular Weight 230.271 g/mol
SMILES N1N(C(=NN2C1c1ccccc1C2=O)CC)C
SPLASH splash10-0f89-0890000000-e5f7f79f9827df60cfab
Source of Spectrum U-1992-124-24
Wiley ID 763775