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2-Acetylpyrazine
SpectraBase Compound ID Eut3rhcHSng
InChI InChI=1S/C6H6N2O/c1-5(9)6-4-7-2-3-8-6/h2-4H,1H3
InChIKey DBZAKQWXICEWNW-UHFFFAOYSA-N
Mol Weight 122.13 g/mol
Molecular Formula C6H6N2O
Exact Mass 122.048013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HPRyU5Fgcbj
Name Pyrazine <2-acetyl->
Source of Sample SAFC Cat.no. W312606
CAS Registry Number 22047-25-2
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 122.048012820 u
Formula C6H6N2O
InChI InChI=1S/C6H6N2O/c1-5(9)6-4-7-2-3-8-6/h2-4H,1H3
InChIKey DBZAKQWXICEWNW-UHFFFAOYSA-N
Molecular Weight 122.127 g/mol
Number of Peaks 45
RI1 1023
RI2 694
RI3 1014
RI4 971
SMILES c1cncc(n1)C(C)=O
SPLASH splash10-0f6x-9100000000-f1dccf11bd82e38e4a89
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Ethanone, 1-pyrazinyl-
Wiley ID LM_FFNSC3_180