CID 4961945

2-(morpholin-4-yl)-1,3-benzoxazol-6-amine

Structural Information

Molecular Formula
C11H13N3O2
SMILES
C1COCCN1C2=NC3=C(O2)C=C(C=C3)N
InChI
InChI=1S/C11H13N3O2/c12-8-1-2-9-10(7-8)16-11(13-9)14-3-5-15-6-4-14/h1-2,7H,3-6,12H2
InChIKey
QAZCAIYMTLZRFY-UHFFFAOYSA-N
Compound name
2-morpholin-4-yl-1,3-benzoxazol-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

219.10077 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.10805 145.7
[M+Na]+ 242.08999 154.2
[M-H]- 218.09349 151.6
[M+NH4]+ 237.13459 161.0
[M+K]+ 258.06393 152.9
[M+H-H2O]+ 202.09803 137.6
[M+HCOO]- 264.09897 165.2
[M+CH3COO]- 278.11462 158.4
[M+Na-2H]- 240.07544 152.8
[M]+ 219.10022 144.8
[M]- 219.10132 144.8
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

patents stripe