CID 55263685

2305252-95-1

Structural Information

Molecular Formula
C5H8N2O
SMILES
CC(C1=COC=N1)N
InChI
InChI=1S/C5H8N2O/c1-4(6)5-2-8-3-7-5/h2-4H,6H2,1H3
InChIKey
MFAOMQZXGBUBMZ-UHFFFAOYSA-N
Compound name
1-(1,3-oxazol-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

112.06366 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.07094 120.4
[M+Na]+ 135.05288 128.3
[M-H]- 111.05638 123.1
[M+NH4]+ 130.09748 141.6
[M+K]+ 151.02682 129.0
[M+H-H2O]+ 95.060920 114.3
[M+HCOO]- 157.06186 144.4
[M+CH3COO]- 171.07751 168.8
[M+Na-2H]- 133.03833 127.3
[M]+ 112.06311 119.6
[M]- 112.06421 119.6
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