CID 62368889

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

Structural Information

Molecular Formula
C8H7ClN2O
SMILES
CC1=CC(=CC2=C1OC(=N2)N)Cl
InChI
InChI=1S/C8H7ClN2O/c1-4-2-5(9)3-6-7(4)12-8(10)11-6/h2-3H,1H3,(H2,10,11)
InChIKey
GJFBSBJBPSHPJC-UHFFFAOYSA-N
Compound name
5-chloro-7-methyl-1,3-benzoxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.02469 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.03197 132.1
[M+Na]+ 205.01391 147.3
[M+NH4]+ 200.05851 141.7
[M+K]+ 220.98785 142.4
[M-H]- 181.01741 136.2
[M+Na-2H]- 202.99936 138.9
[M]+ 182.02414 135.8
[M]- 182.02524 135.8
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.