CID 24208795

916792-12-6

Structural Information

Molecular Formula
C8H9N3O
SMILES
CC1=CC(=NC2=C1C(=NO2)N)C
InChI
InChI=1S/C8H9N3O/c1-4-3-5(2)10-8-6(4)7(9)11-12-8/h3H,1-2H3,(H2,9,11)
InChIKey
DYMSNXTUZQZFSM-UHFFFAOYSA-N
Compound name
4,6-dimethyl-[1,2]oxazolo[5,4-b]pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

98
Patents

163.07455 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.081826 131.3
[M+Na]+ 186.063768 143.8
[M-H]- 162.067274 134.9
[M+NH4]+ 181.108373 151.4
[M+K]+ 202.037708 141.9
[M+H-H2O]+ 146.071810 124.8
[M+HCOO]- 208.072751 155.4
[M+CH3COO]- 222.088401 146.4
[M+Na-2H]- 184.049216 139.5
[M]+ 163.07400142 134.5
[M]- 163.07509858 134.5
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