CID 203371

Pyrrolidine, 1-(1-vinylcyclohexyl)-

Structural Information

Molecular Formula
C12H21N
SMILES
C=CC1(CCCCC1)N2CCCC2
InChI
InChI=1S/C12H21N/c1-2-12(8-4-3-5-9-12)13-10-6-7-11-13/h2H,1,3-11H2
InChIKey
GLVGYRIGWJLLMH-UHFFFAOYSA-N
Compound name
1-(1-ethenylcyclohexyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.1674 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.174676 145.0
[M+Na]+ 202.156618 148.5
[M-H]- 178.160124 148.7
[M+NH4]+ 197.201223 166.7
[M+K]+ 218.130558 145.9
[M+H-H2O]+ 162.164660 137.9
[M+HCOO]- 224.165601 162.5
[M+CH3COO]- 238.181251 179.2
[M+Na-2H]- 200.142066 147.3
[M]+ 179.16685142 136.9
[M]- 179.16794858 136.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.