CID 182198

2,3-diethyl-5,6-dimethylpyrazine

Structural Information

Molecular Formula
C10H16N2
SMILES
CCC1=NC(=C(N=C1CC)C)C
InChI
InChI=1S/C10H16N2/c1-5-9-10(6-2)12-8(4)7(3)11-9/h5-6H2,1-4H3
InChIKey
YAGSHZPMYHTMPZ-UHFFFAOYSA-N
Compound name
2,3-diethyl-5,6-dimethylpyrazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

33
Patents

164.13135 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.13863 136.3
[M+Na]+ 187.12057 146.3
[M-H]- 163.12407 137.8
[M+NH4]+ 182.16517 155.4
[M+K]+ 203.09451 144.0
[M+H-H2O]+ 147.12861 129.6
[M+HCOO]- 209.12955 157.9
[M+CH3COO]- 223.14520 183.2
[M+Na-2H]- 185.10602 142.1
[M]+ 164.13080 138.8
[M]- 164.13190 138.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe