CID 150292145

1-(oxiran-2-yl)cyclopropane-1-carbonitrile

Structural Information

Molecular Formula
C6H7NO
SMILES
C1CC1(C#N)C2CO2
InChI
InChI=1S/C6H7NO/c7-4-6(1-2-6)5-3-8-5/h5H,1-3H2
InChIKey
GHUSSVMJUOEZDC-UHFFFAOYSA-N
Compound name
1-(oxiran-2-yl)cyclopropane-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

109.052765 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.060041 125.2
[M+Na]+ 132.041983 143.0
[M-H]- 108.045489 136.2
[M+NH4]+ 127.086588 139.0
[M+K]+ 148.015923 139.0
[M+H-H2O]+ 92.050025 119.6
[M+HCOO]- 154.050966 145.4
[M+CH3COO]- 168.066616 193.3
[M+Na-2H]- 130.027431 135.6
[M]+ 109.05221642 128.7
[M]- 109.05331358 128.7
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

No patent data available for this compound.