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5,5,9-trimethyl-3H-chromeno[4,3-e][1,2,4]triazin-2-one
SpectraBase Compound ID 4UtNIow0fRt
InChI InChI=1S/C13H13N3O2/c1-7-4-5-9-8(6-7)10-11(13(2,3)18-9)15-16-12(17)14-10/h4-6H,1-3H3,(H,14,16,17)
InChIKey UNUWAMQLCFRNHP-UHFFFAOYSA-N
Mol Weight 243.27 g/mol
Molecular Formula C13H13N3O2
Exact Mass 243.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xSUx6ZpD52
Name 5,5,9-trimethyl-3H-chromeno[4,3-e][1,2,4]triazin-2-one
Alternate Name(s) 5,5,9-trimethyl-3H-[1]benzopyrano[4,3-e][1,2,4]triazin-2-one
CAS Registry Number 96918-32-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N3O2
InChI InChI=1S/C13H13N3O2/c1-7-4-5-9-8(6-7)10-11(13(2,3)18-9)15-16-12(17)14-10/h4-6H,1-3H3,(H,14,16,17)
InChIKey UNUWAMQLCFRNHP-UHFFFAOYSA-N
Molecular Weight 243.266 g/mol
SMILES N1N=C2C(=NC1=O)c1cc(ccc1OC2(C)C)C
SPLASH splash10-004l-0190000000-2cd5d1d9ea2ce9db31ce
Source of Spectrum Y-22-36-4
Wiley ID 1246006