CID 117538395

4-methyl-5-(pyridin-3-yl)-1,3-oxazol-2-amine

Structural Information

Molecular Formula
C9H9N3O
SMILES
CC1=C(OC(=N1)N)C2=CN=CC=C2
InChI
InChI=1S/C9H9N3O/c1-6-8(13-9(10)12-6)7-3-2-4-11-5-7/h2-5H,1H3,(H2,10,12)
InChIKey
XXEGWMWLIUVHTE-UHFFFAOYSA-N
Compound name
4-methyl-5-pyridin-3-yl-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.07455 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.081826 135.0
[M+Na]+ 198.063768 145.0
[M-H]- 174.067274 140.2
[M+NH4]+ 193.108373 152.8
[M+K]+ 214.037708 143.1
[M+H-H2O]+ 158.071810 127.3
[M+HCOO]- 220.072751 159.0
[M+CH3COO]- 234.088401 149.2
[M+Na-2H]- 196.049216 141.9
[M]+ 175.07400142 135.3
[M]- 175.07509858 135.3
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.