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3-(Hydroxymethyl)-4H,6H-[1,2,3]triazolo[1,5-a][4,1]benzoxazepin-6-one
SpectraBase Compound ID 7HTEnGXbexo
InChI InChI=1S/C11H9N3O3/c15-5-8-10-6-17-11(16)7-3-1-2-4-9(7)14(10)13-12-8/h1-4,15H,5-6H2
InChIKey GNTDATKRKKBCEM-UHFFFAOYSA-N
Mol Weight 231.21 g/mol
Molecular Formula C11H9N3O3
Exact Mass 231.064391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gi4Zd47L91p
Name 3-(Hydroxymethyl)-4H,6H-[1,2,3]triazolo[1,5-a][4,1]benzoxazepin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N3O3
InChI InChI=1S/C11H9N3O3/c15-5-8-10-6-17-11(16)7-3-1-2-4-9(7)14(10)13-12-8/h1-4,15H,5-6H2
InChIKey GNTDATKRKKBCEM-UHFFFAOYSA-N
Molecular Weight 231.211 g/mol
SMILES OCc1c2[n](nn1)-c1c(C(=O)OC2)cccc1
SPLASH splash10-001i-1390000000-afcd9eb40c68ee6c7621
Source of Spectrum Y-50-533-3b
Synonyms 3-(hydroxymethyl)benzo[e][1,2,3]triazolo[5,1-c][1,4]oxazepin-6(4H)-one 3-(hydroxymethyl)-4H-triazolo[1,5-a][4,1]benzoxazepin-6-one 3-(hydroxymethyl)-4H-[1,2,3]triazolo[1,5-a][4,1]benzoxazepin-6-one
Wiley ID 1736688