CID 130706920

(4-bromo-1,2-oxazol-5-yl)methanol

Structural Information

Molecular Formula
C4H4BrNO2
SMILES
C1=NOC(=C1Br)CO
InChI
InChI=1S/C4H4BrNO2/c5-3-1-6-8-4(3)2-7/h1,7H,2H2
InChIKey
AMDVELFPCONGRT-UHFFFAOYSA-N
Compound name
(4-bromo-1,2-oxazol-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.94254 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.94982 130.9
[M+Na]+ 199.93176 133.5
[M+NH4]+ 194.97636 135.3
[M+K]+ 215.90570 136.2
[M-H]- 175.93526 130.9
[M+Na-2H]- 197.91721 132.9
[M]+ 176.94199 130.0
[M]- 176.94309 130.0
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.