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6-Benzyl-3-(2-chlorophenyloxymethyl)-1,2,4-triazolo[4,3-b]1,2,4-triazine-7(8H)-one
SpectraBase Compound ID GsccFiG2DCV
InChI InChI=1S/C18H14ClN5O2/c19-13-8-4-5-9-15(13)26-11-16-21-22-18-20-17(25)14(23-24(16)18)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,22,25)
InChIKey DRJSMBACFOAJGL-UHFFFAOYSA-N
Mol Weight 367.8 g/mol
Molecular Formula C18H14ClN5O2
Exact Mass 367.083602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrMKU8SZ9h5
Name 6-Benzyl-3-(2-chlorophenyloxymethyl)-1,2,4-triazolo[4,3-b]1,2,4-triazine-7(8H)-one
Alternate Name(s) 6-Benzyl-3-[(2-chlorophenoxy)methyl][1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14ClN5O2
InChI InChI=1S/C18H14ClN5O2/c19-13-8-4-5-9-15(13)26-11-16-21-22-18-20-17(25)14(23-24(16)18)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,22,25)
InChIKey DRJSMBACFOAJGL-UHFFFAOYSA-N
Molecular Weight 367.796 g/mol
SMILES N1C(C(=N[n]2c1nnc2COc1c(cccc1)Cl)Cc1ccccc1)=O
SPLASH splash10-004l-0901000000-3b1fdd446b58ba1be92b
Source of Spectrum Y1-42-2057-4
Wiley ID 1565296