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Ethyl 2-Methyl-1,3,3a-triazacyclopent[a]azulen-9-carboxylate
SpectraBase Compound ID CXBQ37zIMn4
InChI InChI=1S/C14H13N3O2/c1-3-19-14(18)12-10-7-5-4-6-8-11(10)17-13(12)15-9(2)16-17/h4-8H,3H2,1-2H3
InChIKey YFQXGZTVVRNCSD-UHFFFAOYSA-N
Mol Weight 255.28 g/mol
Molecular Formula C14H13N3O2
Exact Mass 255.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tHsH25j1yr
Name Ethyl 2-Methyl-1,3,3a-triazacyclopent[a]azulen-9-carboxylate
Alternate Name(s) Ethyl 2-methylcyclohepta[4,5]pyrrolo[1,2-b][1,2,4]triazole-10-carboxylate 2-Methyl-10-cyclohepta[1,2]pyrrolo[2,5-b][1,2,4]triazolecarboxylic acid ethyl ester Ethyl 2-methylcyclohepta[1,2]pyrrolo[2,5-b][1,2,4]triazole-10-carboxylate
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Formula C14H13N3O2
InChI InChI=1S/C14H13N3O2/c1-3-19-14(18)12-10-7-5-4-6-8-11(10)17-13(12)15-9(2)16-17/h4-8H,3H2,1-2H3
InChIKey YFQXGZTVVRNCSD-UHFFFAOYSA-N
Molecular Weight 255.277 g/mol
SMILES c12[n](C3=CC=CC=CC3=C2C(=O)OCC)nc(n1)C
SPLASH splash10-001i-0910000000-ff08c4c0c2b90a955727
Source of Spectrum KC-0-1343-14
Wiley ID 827966