CID 7213124

2-bromothiazole-5-methanol

Structural Information

Molecular Formula
C4H4BrNOS
SMILES
C1=C(SC(=N1)Br)CO
InChI
InChI=1S/C4H4BrNOS/c5-4-6-1-3(2-7)8-4/h1,7H,2H2
InChIKey
DWNJWSPPORNJGV-UHFFFAOYSA-N
Compound name
(2-bromo-1,3-thiazol-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

308
Patents

192.9197 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.92698 125.1
[M+Na]+ 215.90892 127.3
[M+NH4]+ 210.95352 130.5
[M+K]+ 231.88286 128.1
[M-H]- 191.91242 124.7
[M+Na-2H]- 213.89437 127.6
[M]+ 192.91915 124.4
[M]- 192.92025 124.4
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