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12,13-Dimethyl-9,10-dihydro-8H-benzo[3',4']cyclohepta[2',1':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

View entire compound with spectra: 1 MS (GC)

12,13-Dimethyl-9,10-dihydro-8H-benzo[3',4']cyclohepta[2',1':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
SpectraBase Compound ID 1EEVu9m5Fzy
InChI InChI=1S/C18H16N4S/c1-10-6-12-4-3-5-14-15(13(12)7-11(10)2)16-17-19-8-21-22(17)9-20-18(16)23-14/h6-9H,3-5H2,1-2H3
InChIKey HTANASCYNMQUCZ-UHFFFAOYSA-N
Mol Weight 320.41 g/mol
Molecular Formula C18H16N4S
Exact Mass 320.109568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2i6txuBGXw
Name 12,13-Dimethyl-9,10-dihydro-8H-benzo[3',4']cyclohepta[2',1':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Alternate Name(s) 12,13-dimethyl-9,10-dihydro-8H-benzo[6',7']cyclohepta[1',2':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
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Formula C18H16N4S
InChI InChI=1S/C18H16N4S/c1-10-6-12-4-3-5-14-15(13(12)7-11(10)2)16-17-19-8-21-22(17)9-20-18(16)23-14/h6-9H,3-5H2,1-2H3
InChIKey HTANASCYNMQUCZ-UHFFFAOYSA-N
Molecular Weight 320.414 g/mol
SMILES c1-2c(N=C[n]3c2ncn3)sc2c1-c1cc(C)c(cc1CCC2)C
SPLASH splash10-05fr-5019000000-93901bd57b0844d2a79d
Source of Spectrum CV-0-497-8
Wiley ID 849111