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Ethyl 6-methyl-1-(4-methylphenyl)-1,4-dihydro[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazine-3-carboxylate
SpectraBase Compound ID 1X5Wdidf3lQ
InChI InChI=1S/C14H16N6O2/c1-4-22-13(21)12-17-19-10(3)15-16-14(19)20(18-12)11-7-5-9(2)6-8-11/h5-8H,4H2,1-3H3,(H,17,18)
InChIKey SWCQHZVGWFJSHU-UHFFFAOYSA-N
Mol Weight 300.32 g/mol
Molecular Formula C14H16N6O2
Exact Mass 300.133474 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rqjp7Gh46D
Name Ethyl 6-methyl-1-(4-methylphenyl)-1,4-dihydro[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N6O2
InChI InChI=1S/C14H16N6O2/c1-4-22-13(21)12-17-19-10(3)15-16-14(19)20(18-12)11-7-5-9(2)6-8-11/h5-8H,4H2,1-3H3,(H,17,18)
InChIKey SWCQHZVGWFJSHU-UHFFFAOYSA-N
Instrument Name GCMS-Q1000-EX Shimadzu/GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.b06
Molecular Weight 300.322 g/mol
SMILES N1[n]2c(nnc2N(N=C1C(OCC)=O)c1ccc(cc1)C)C
SPLASH splash10-0udl-4039000000-8698c9122878ed9ba9bf
Source of Spectrum ARK-2009-63-5c
Wiley ID 1866511