CID 590605

N-methyl-1,3-benzoxazol-2-amine

Structural Information

Molecular Formula
C8H8N2O
SMILES
CNC1=NC2=CC=CC=C2O1
InChI
InChI=1S/C8H8N2O/c1-9-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H,9,10)
InChIKey
RNDXNZLSLYKBAX-UHFFFAOYSA-N
Compound name
N-methyl-1,3-benzoxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

103
Patents

148.06366 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.07094 126.0
[M+Na]+ 171.05288 139.9
[M+NH4]+ 166.09748 135.5
[M+K]+ 187.02682 135.3
[M-H]- 147.05638 130.1
[M+Na-2H]- 169.03833 133.7
[M]+ 148.06311 129.2
[M]- 148.06421 129.2
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

patents stripe