CID 71721162

(4-bromo-1h-imidazol-2-yl)methanol hydrochloride

Structural Information

Molecular Formula
C4H5BrN2O
SMILES
C1=C(NC(=N1)CO)Br
InChI
InChI=1S/C4H5BrN2O/c5-3-1-6-4(2-8)7-3/h1,8H,2H2,(H,6,7)
InChIKey
ABAMLDFAOYYEGL-UHFFFAOYSA-N
Compound name
(5-bromo-1H-imidazol-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.95853 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.96581 133.8
[M+Na]+ 198.94775 135.7
[M+NH4]+ 193.99235 137.7
[M+K]+ 214.92169 138.1
[M-H]- 174.95125 131.8
[M+Na-2H]- 196.93320 135.5
[M]+ 175.95798 132.1
[M]- 175.95908 132.1
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.