CID 79980912

3-(4-cyclopropylphenyl)pyrrolidine hydrochloride

Structural Information

Molecular Formula
C13H17N
SMILES
C1CC1C2=CC=C(C=C2)C3CCNC3
InChI
InChI=1S/C13H17N/c1-2-10(1)11-3-5-12(6-4-11)13-7-8-14-9-13/h3-6,10,13-14H,1-2,7-9H2
InChIKey
ARESOPXQUQRKRJ-UHFFFAOYSA-N
Compound name
3-(4-cyclopropylphenyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.1361 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.14338 140.0
[M+Na]+ 210.12532 147.6
[M-H]- 186.12882 147.2
[M+NH4]+ 205.16992 154.4
[M+K]+ 226.09926 143.0
[M+H-H2O]+ 170.13336 132.6
[M+HCOO]- 232.13430 160.6
[M+CH3COO]- 246.14995 152.1
[M+Na-2H]- 208.11077 143.6
[M]+ 187.13555 137.0
[M]- 187.13665 137.0
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.