CID 130874220

N-(1,2-oxazol-3-yl)but-2-ynamide

Structural Information

Molecular Formula
C7H6N2O2
SMILES
CC#CC(=O)NC1=NOC=C1
InChI
InChI=1S/C7H6N2O2/c1-2-3-7(10)8-6-4-5-11-9-6/h4-5H,1H3,(H,8,9,10)
InChIKey
FRPRAJKOKNDYIZ-UHFFFAOYSA-N
Compound name
N-(1,2-oxazol-3-yl)but-2-ynamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.04292 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.05020 132.5
[M+Na]+ 173.03214 142.6
[M+NH4]+ 168.07674 136.1
[M+K]+ 189.00608 136.7
[M-H]- 149.03564 125.9
[M+Na-2H]- 171.01759 134.3
[M]+ 150.04237 131.0
[M]- 150.04347 131.0
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.