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4-[1,2,5]Oxadiazolo[3,4-b]pyrazin-5-ylbenzonitrile
SpectraBase Compound ID LGcC3aY8NXK
InChI InChI=1S/C11H5N5O/c12-5-7-1-3-8(4-2-7)9-6-13-10-11(14-9)16-17-15-10/h1-4,6H
InChIKey HOKWAXNKELQIGU-UHFFFAOYSA-N
Mol Weight 223.19 g/mol
Molecular Formula C11H5N5O
Exact Mass 223.04941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8hRROV1uqc6
Name 4-[1,2,5]Oxadiazolo[3,4-b]pyrazin-5-ylbenzonitrile
Appearance Light yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.049409800 u
Formula C11H5N5O
InChI InChI=1S/C11H5N5O/c12-5-7-1-3-8(4-2-7)9-6-13-10-11(14-9)16-17-15-10/h1-4,6H
InChIKey HOKWAXNKELQIGU-UHFFFAOYSA-N
Instrument Name Finnigan MAT/INCOS 50
Ionization Type EI
Literature Reference DOI 10.1016/j.rechem.2022.100704
Molecular Weight 223.195 g/mol
Quality 405
SMILES C=12N=C(C=NC2=NON1)C=1C=CC(=CC1)C#N
SPLASH splash10-007o-3940000000-951a32dacfec80aeb779
Source of Spectrum REC-5-SM54-26 (DOI: 10.1016/j.rechem.2022.100704)
Wiley ID 1911813