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8,9-DIMETHYLENE-4-METHYL-2,4,6-TRIAZA-TRICYCLO-[5.1.1.0(2,6)]-NONANE-3,5-DIONE
SpectraBase Compound ID FbXuSY07Uof
InChI InChI=1S/C9H9N3O2/c1-4-6-5(2)7(4)12-9(14)10(3)8(13)11(6)12/h6-7H,1-2H2,3H3/t6-,7+
InChIKey XMZHGYOLIBMHNX-KNVOCYPGSA-N
Mol Weight 191.19 g/mol
Molecular Formula C9H9N3O2
Exact Mass 191.069477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpcUiiLind5
Name 5,7-Methano-1H,5H-pyrazolo[1,2-a][1,2,4]triazole-1,3(2H)-dione, dihydro-2-methyl-6,9-bis(methylene)-
CAS Registry Number 120476-21-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3O2
InChI InChI=1S/C9H9N3O2/c1-4-6-5(2)7(4)12-9(14)10(3)8(13)11(6)12/h6-7H,1-2H2,3H3/t6-,7+
InChIKey XMZHGYOLIBMHNX-KNVOCYPGSA-N
Molecular Weight 191.190 g/mol
SMILES C1(N2N(C(N1C)=O)[C@@]1(C([C@]2(C1=C)[H])=C)[H])=O
SPLASH splash10-0fb9-9300000000-eb578ef84f083a5ddbc9
Source of Spectrum C-111-3940-18
Synonyms 4-Methyl-8,9-dimethylene-2,4,6-triazatricyclo[5.1.1.0(2,6)]nonane-3,5-dione 8,9-Dimethylene-4-methyl-2,4,6-triazatricyclo[5.1.1.0(2,6)]nonane-3,5-dione
Wiley ID 1187355