CID 4442674

2-(cyclohexylmethyl)pyrrolidine

Structural Information

Molecular Formula
C11H21N
SMILES
C1CCC(CC1)CC2CCCN2
InChI
InChI=1S/C11H21N/c1-2-5-10(6-3-1)9-11-7-4-8-12-11/h10-12H,1-9H2
InChIKey
HTQOKLUJNQCMHG-UHFFFAOYSA-N
Compound name
2-(cyclohexylmethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

167.1674 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.17468 143.0
[M+Na]+ 190.15662 152.1
[M+NH4]+ 185.20122 152.4
[M+K]+ 206.13056 146.8
[M-H]- 166.16012 145.9
[M+Na-2H]- 188.14207 147.8
[M]+ 167.16685 144.8
[M]- 167.16795 144.8
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