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2-Butanone, 1-[3,6-dihydro-6-methyl-3-(1-oxopropyl)-7H-thiazolo[5,4-e]-1,2,3-benzotriazol-7-ylidene]-
SpectraBase Compound ID KbBrJ6AQDFr
InChI InChI=1S/C15H16N4O2S/c1-4-9(20)8-13-18(3)11-7-6-10-14(15(11)22-13)16-17-19(10)12(21)5-2/h6-8H,4-5H2,1-3H3/b13-8+
InChIKey LKMNODXEZNPEJY-MDWZMJQESA-N
Mol Weight 316.38 g/mol
Molecular Formula C15H16N4O2S
Exact Mass 316.099397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7wVNJd0Jkur
Name 2-Butanone, 1-[3,6-dihydro-6-methyl-3-(1-oxopropyl)-7H-thiazolo[5,4-e]-1,2,3-benzotriazol-7-ylidene]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16N4O2S
InChI InChI=1S/C15H16N4O2S/c1-4-9(20)8-13-18(3)11-7-6-10-14(15(11)22-13)16-17-19(10)12(21)5-2/h6-8H,4-5H2,1-3H3/b13-8+
InChIKey LKMNODXEZNPEJY-MDWZMJQESA-N
Molecular Weight 316.379 g/mol
SMILES CCC(=O)\C=C\1Sc2c(ccc3[n](nnc23)C(=O)CC)N1C
SPLASH splash10-0059-7391000000-af13be93232c86c07c25
Source of Spectrum JX-2015-3-123
Synonyms (E)-1-(6-methyl-3-propionyl-3H-thiazolo[5',4':3,4]benzo[1,2-d][1,2,3]triazol-7(6H)-ylidene)butan-2-one (1E)-1-[6-methyl-3-(1-oxopropyl)-7-thiazolo[5,4-e]benzotriazolylidene]-2-butanone (1E)-1-(6-methyl-3-propanoyl-thiazolo[5,4-e]benzotriazol-7-ylidene)butan-2-one (1E)-1-(6-methyl-3-propanoyl-[1,3]thiazolo[5,4-e]benzotriazol-7-ylidene)butan-2-one
Wiley ID 1723722