CID 535824

35629-70-0

Structural Information

Molecular Formula
C4H6N2O
SMILES
CC1=COC(=N1)N
InChI
InChI=1S/C4H6N2O/c1-3-2-7-4(5)6-3/h2H,1H3,(H2,5,6)
InChIKey
VCZJVXLWQTXSPQ-UHFFFAOYSA-N
Compound name
4-methyl-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

228
Patents

98.04801 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.055286 115.1
[M+Na]+ 121.03723 126.5
[M+NH4]+ 116.08183 123.6
[M+K]+ 137.01117 123.8
[M-H]- 97.040734 117.7
[M+Na-2H]- 119.02268 120.8
[M]+ 98.047461 117.2
[M]- 98.048559 117.2
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