CID 44119606

1065073-45-1

Structural Information

Molecular Formula
C5H8N2O
SMILES
CC1=NC(=CO1)CN
InChI
InChI=1S/C5H8N2O/c1-4-7-5(2-6)3-8-4/h3H,2,6H2,1H3
InChIKey
ZFKWYIYSYDLCCG-UHFFFAOYSA-N
Compound name
(2-methyl-1,3-oxazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
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 119.6
[M+Na]+ 135.05288 130.8
[M+NH4]+ 130.09748 128.0
[M+K]+ 151.02682 127.9
[M-H]- 111.05638 122.2
[M+Na-2H]- 133.03833 125.1
[M]+ 112.06311 121.7
[M]- 112.06421 121.7
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