CID 14976610

2-methylcyclopentane-1-carbonitrile

Structural Information

Molecular Formula
C7H11N
SMILES
CC1CCCC1C#N
InChI
InChI=1S/C7H11N/c1-6-3-2-4-7(6)5-8/h6-7H,2-4H2,1H3
InChIKey
ZJIHBZDKEFKVBZ-UHFFFAOYSA-N
Compound name
2-methylcyclopentane-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

109.08915 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.096426 121.9
[M+Na]+ 132.078368 131.4
[M-H]- 108.081874 125.3
[M+NH4]+ 127.122973 144.3
[M+K]+ 148.052308 129.1
[M+H-H2O]+ 92.086410 110.6
[M+HCOO]- 154.087351 141.5
[M+CH3COO]- 168.103001 182.2
[M+Na-2H]- 130.063816 126.5
[M]+ 109.08860142 114.7
[M]- 109.08969858 114.7
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