CID 33786056

1152583-84-0

Structural Information

Molecular Formula
C11H10N4O
SMILES
CN1C=C(C=N1)C2=NC3=C(O2)C=C(C=C3)N
InChI
InChI=1S/C11H10N4O/c1-15-6-7(5-13-15)11-14-9-3-2-8(12)4-10(9)16-11/h2-6H,12H2,1H3
InChIKey
JGWXXAAJPYFBMK-UHFFFAOYSA-N
Compound name
2-(1-methylpyrazol-4-yl)-1,3-benzoxazol-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.08546 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.09274 143.6
[M+Na]+ 237.07468 157.9
[M+NH4]+ 232.11928 151.7
[M+K]+ 253.04862 155.9
[M-H]- 213.07818 147.9
[M+Na-2H]- 235.06013 150.9
[M]+ 214.08491 146.8
[M]- 214.08601 146.8
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.