CID 938544

5-hydrazinyl-2-methyl-1,3-oxazole-4-carbonitrile

Structural Information

Molecular Formula
C5H6N4O
SMILES
CC1=NC(=C(O1)NN)C#N
InChI
InChI=1S/C5H6N4O/c1-3-8-4(2-6)5(9-7)10-3/h9H,7H2,1H3
InChIKey
KTYJFUFFTAJDKX-UHFFFAOYSA-N
Compound name
5-hydrazinyl-2-methyl-1,3-oxazole-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

138.05415 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.06143 125.3
[M+Na]+ 161.04337 135.6
[M-H]- 137.04687 127.5
[M+NH4]+ 156.08797 143.2
[M+K]+ 177.01731 135.3
[M+H-H2O]+ 121.05141 111.8
[M+HCOO]- 183.05235 147.0
[M+CH3COO]- 197.06800 189.4
[M+Na-2H]- 159.02882 131.7
[M]+ 138.05360 119.8
[M]- 138.05470 119.8
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