CID 57187562

1-formylcyclopropane-1-carbonitrile

Structural Information

Molecular Formula
C5H5NO
SMILES
C1CC1(C=O)C#N
InChI
InChI=1S/C5H5NO/c6-3-5(4-7)1-2-5/h4H,1-2H2
InChIKey
ZVJZAKIRDRMLDW-UHFFFAOYSA-N
Compound name
1-formylcyclopropane-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

147
Patents

95.03712 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 96.044396 119.6
[M+Na]+ 118.02634 131.7
[M+NH4]+ 113.07094 126.7
[M+K]+ 134.00028 123.3
[M-H]- 94.029844 120.1
[M+Na-2H]- 116.01179 126.8
[M]+ 95.036571 121.7
[M]- 95.037669 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