CID 16079540

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

Structural Information

Molecular Formula
C9H9N3O
SMILES
CC1=C(ON=C1C2=CC=CC=N2)N
InChI
InChI=1S/C9H9N3O/c1-6-8(12-13-9(6)10)7-4-2-3-5-11-7/h2-5H,10H2,1H3
InChIKey
RGRVQGDBHBFSRX-UHFFFAOYSA-N
Compound name
4-methyl-3-pyridin-2-yl-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

175.07455 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.08183 135.0
[M+Na]+ 198.06377 145.0
[M-H]- 174.06727 140.2
[M+NH4]+ 193.10837 152.8
[M+K]+ 214.03771 143.1
[M+H-H2O]+ 158.07181 127.3
[M+HCOO]- 220.07275 159.0
[M+CH3COO]- 234.08840 149.2
[M+Na-2H]- 196.04922 141.9
[M]+ 175.07400 135.3
[M]- 175.07510 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

literature stripe

Patent stripe

patents stripe