CID 202079

1-(1-allylcyclohexyl)pyrrolidine

Structural Information

Molecular Formula
C13H23N
SMILES
C=CCC1(CCCCC1)N2CCCC2
InChI
InChI=1S/C13H23N/c1-2-8-13(9-4-3-5-10-13)14-11-6-7-12-14/h2H,1,3-12H2
InChIKey
LYJRVYUVVDMOSM-UHFFFAOYSA-N
Compound name
1-(1-prop-2-enylcyclohexyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.18304 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.19032 149.5
[M+Na]+ 216.17226 152.5
[M-H]- 192.17576 152.9
[M+NH4]+ 211.21686 170.6
[M+K]+ 232.14620 149.7
[M+H-H2O]+ 176.18030 142.1
[M+HCOO]- 238.18124 166.6
[M+CH3COO]- 252.19689 182.2
[M+Na-2H]- 214.15771 151.2
[M]+ 193.18249 141.7
[M]- 193.18359 141.7
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.