CID 23462006

(5-bromopyrazin-2-yl)methanol

Structural Information

Molecular Formula
C5H5BrN2O
SMILES
C1=C(N=CC(=N1)Br)CO
InChI
InChI=1S/C5H5BrN2O/c6-5-2-7-4(3-9)1-8-5/h1-2,9H,3H2
InChIKey
ODWYKQVKPFNPDG-UHFFFAOYSA-N
Compound name
(5-bromopyrazin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

187.95853 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.96581 130.3
[M+Na]+ 210.94775 134.3
[M+NH4]+ 205.99235 134.8
[M+K]+ 226.92169 134.6
[M-H]- 186.95125 129.7
[M+Na-2H]- 208.93320 134.4
[M]+ 187.95798 129.4
[M]- 187.95908 129.4
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