CID 12371364

4-bromo-5-phenyl-1,2-oxazol-3-amine

Structural Information

Molecular Formula
C9H7BrN2O
SMILES
C1=CC=C(C=C1)C2=C(C(=NO2)N)Br
InChI
InChI=1S/C9H7BrN2O/c10-7-8(13-12-9(7)11)6-4-2-1-3-5-6/h1-5H,(H2,11,12)
InChIKey
SKMYIFOUGLCRPK-UHFFFAOYSA-N
Compound name
4-bromo-5-phenyl-1,2-oxazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

237.97418 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.98146 146.1
[M+Na]+ 260.96340 150.2
[M+NH4]+ 256.00800 151.1
[M+K]+ 276.93734 151.6
[M-H]- 236.96690 149.4
[M+Na-2H]- 258.94885 150.6
[M]+ 237.97363 146.4
[M]- 237.97473 146.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.