CID 3057963

1-(1-phenylpropyl)pyrrolidine hydrochloride

Structural Information

Molecular Formula
C13H19N
SMILES
CCC(C1=CC=CC=C1)N2CCCC2
InChI
InChI=1S/C13H19N/c1-2-13(14-10-6-7-11-14)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3
InChIKey
CNCVMCNGUPWUSW-UHFFFAOYSA-N
Compound name
1-(1-phenylpropyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

189.15175 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 146.0
[M+Na]+ 212.14097 157.7
[M+NH4]+ 207.18557 155.5
[M+K]+ 228.11491 151.9
[M-H]- 188.14447 149.8
[M+Na-2H]- 210.12642 153.4
[M]+ 189.15120 148.7
[M]- 189.15230 148.7
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