CID 62589496

2-(2-methoxyethyl)-1,3-benzoxazol-5-amine

Structural Information

Molecular Formula
C10H12N2O2
SMILES
COCCC1=NC2=C(O1)C=CC(=C2)N
InChI
InChI=1S/C10H12N2O2/c1-13-5-4-10-12-8-6-7(11)2-3-9(8)14-10/h2-3,6H,4-5,11H2,1H3
InChIKey
JFQLYTZOVBBXDT-UHFFFAOYSA-N
Compound name
2-(2-methoxyethyl)-1,3-benzoxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.08987 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.097146 138.4
[M+Na]+ 215.079088 148.9
[M-H]- 191.082594 142.7
[M+NH4]+ 210.123693 158.2
[M+K]+ 231.053028 147.3
[M+H-H2O]+ 175.087130 132.0
[M+HCOO]- 237.088071 163.4
[M+CH3COO]- 251.103721 184.6
[M+Na-2H]- 213.064536 146.5
[M]+ 192.08932142 142.8
[M]- 192.09041858 142.8
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.