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Pyrimidine
SpectraBase Compound ID DqGrY3XqIkG
InChI InChI=1S/C4H4N2/c1-2-5-4-6-3-1/h1-4H
InChIKey CZPWVGJYEJSRLH-UHFFFAOYSA-N
Mol Weight 80.09 g/mol
Molecular Formula C4H4N2
Exact Mass 80.037448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcWqnZAKUBV
Name 1,3-Diazabenzene
CAS Registry Number 289-95-2
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 80.037448137 u
Formula C4H4N2
InChI InChI=1S/C4H4N2/c1-2-5-4-6-3-1/h1-4H
InChIKey CZPWVGJYEJSRLH-UHFFFAOYSA-N
Molecular Weight 80.090 g/mol
Number of Peaks 25
RI1 749
RI2 421
RI3 653
RI4 609
RI5 724
SMILES c1ncccn1
SPLASH splash10-0f89-9000000000-b093eac17940915aae25
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 Pyrimidine
Wiley ID LM_FFNSC3_3189