CID 46384

7-chloro-1,3-benzoxazol-2-amine

Structural Information

Molecular Formula
C7H5ClN2O
SMILES
C1=CC2=C(C(=C1)Cl)OC(=N2)N
InChI
InChI=1S/C7H5ClN2O/c8-4-2-1-3-5-6(4)11-7(9)10-5/h1-3H,(H2,9,10)
InChIKey
ZNJCQBBJHFLQAG-UHFFFAOYSA-N
Compound name
7-chloro-1,3-benzoxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

168.00903 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.01631 127.5
[M+Na]+ 190.99825 142.5
[M+NH4]+ 186.04285 137.2
[M+K]+ 206.97219 137.6
[M-H]- 167.00175 131.5
[M+Na-2H]- 188.98370 134.8
[M]+ 168.00848 131.1
[M]- 168.00958 131.1
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

patents stripe