CID 13867573

2,3-dibromo-5,6-dimethylpyrazine

Structural Information

Molecular Formula
C6H6Br2N2
SMILES
CC1=C(N=C(C(=N1)Br)Br)C
InChI
InChI=1S/C6H6Br2N2/c1-3-4(2)10-6(8)5(7)9-3/h1-2H3
InChIKey
VGHYTIFAMHSLPM-UHFFFAOYSA-N
Compound name
2,3-dibromo-5,6-dimethylpyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.88977 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.89705 126.2
[M+Na]+ 286.87899 139.4
[M-H]- 262.88249 131.8
[M+NH4]+ 281.92359 145.2
[M+K]+ 302.85293 124.3
[M+H-H2O]+ 246.88703 134.5
[M+HCOO]- 308.88797 142.0
[M+CH3COO]- 322.90362 199.8
[M+Na-2H]- 284.86444 135.3
[M]+ 263.88922 161.2
[M]- 263.89032 161.2
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

No patent data available for this compound.