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4,5-dihydro-2H-[1,2,4]triazolo[3,4-d][1,5]benzoxazepin-1-one
SpectraBase Compound ID D4cs592frW3
InChI InChI=1S/C10H9N3O2/c14-10-12-11-9-5-6-15-8-4-2-1-3-7(8)13(9)10/h1-4H,5-6H2,(H,12,14)
InChIKey HYOZRNVSAYJVCV-UHFFFAOYSA-N
Mol Weight 203.2 g/mol
Molecular Formula C10H9N3O2
Exact Mass 203.069477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEVePV6kCbt
Name 4,5-dihydro-2H-[1,2,4]triazolo[3,4-d][1,5]benzoxazepin-1-one
CAS Registry Number 130223-89-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9N3O2
InChI InChI=1S/C10H9N3O2/c14-10-12-11-9-5-6-15-8-4-2-1-3-7(8)13(9)10/h1-4H,5-6H2,(H,12,14)
InChIKey HYOZRNVSAYJVCV-UHFFFAOYSA-N
Molecular Weight 203.201 g/mol
SMILES N1N=C2N(C1=O)c1c(OCC2)cccc1
SPLASH splash10-0udi-0390000000-dfa56d5b13ed3640c987
Source of Spectrum Y-27-993-7
Synonyms 4,5-Dihydro[1,2,4]triazolo[3,4-d][1,5]benzoxazepin-1(2H)-one
Wiley ID 1200692