CID 10057713

3325-77-7

Structural Information

Molecular Formula
C8H11NO2
SMILES
CCOC(=O)C1(CC1C#N)C
InChI
InChI=1S/C8H11NO2/c1-3-11-7(10)8(2)4-6(8)5-9/h6H,3-4H2,1-2H3
InChIKey
KJONXUIDBVZZLB-UHFFFAOYSA-N
Compound name
ethyl 2-cyano-1-methylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.07898 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.086256 128.9
[M+Na]+ 176.068198 144.9
[M-H]- 152.071704 136.0
[M+NH4]+ 171.112803 147.5
[M+K]+ 192.042138 140.6
[M+H-H2O]+ 136.076240 121.1
[M+HCOO]- 198.077181 150.3
[M+CH3COO]- 212.092831 192.4
[M+Na-2H]- 174.053646 136.6
[M]+ 153.07843142 131.0
[M]- 153.07952858 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.