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6,6-Dimethyl-2-(4'-chlorophenyl)-(1,2,3)-triazol[4,5-c]azepin-4-one
SpectraBase Compound ID Kmy7IPg1Fjk
InChI InChI=1S/C14H15ClN4O/c1-14(2)8-7-11-12(13(20)16-14)18-19(17-11)10-5-3-9(15)4-6-10/h3-6H,7-8H2,1-2H3,(H,16,20)
InChIKey YNFSQJCMOYBVFN-UHFFFAOYSA-N
Mol Weight 290.75 g/mol
Molecular Formula C14H15ClN4O
Exact Mass 290.093439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgFI8Ds8jI6
Name 6,6-Dimethyl-2-(4'-chlorophenyl)-(1,2,3)-triazol[4,5-c]azepin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15ClN4O
InChI InChI=1S/C14H15ClN4O/c1-14(2)8-7-11-12(13(20)16-14)18-19(17-11)10-5-3-9(15)4-6-10/h3-6H,7-8H2,1-2H3,(H,16,20)
InChIKey YNFSQJCMOYBVFN-UHFFFAOYSA-N
Molecular Weight 290.754 g/mol
SMILES N1C(CCc2n[n](nc2C1=O)-c1ccc(cc1)Cl)(C)C
SPLASH splash10-000f-0090000000-cae8ff74f26009e6b6ec
Source of Spectrum G-55-248-0
Wiley ID 748222