CID 261892

2-phenylpyrrolidine

Structural Information

Molecular Formula
C10H13N
SMILES
C1CC(NC1)C2=CC=CC=C2
InChI
InChI=1S/C10H13N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-3,5-6,10-11H,4,7-8H2
InChIKey
JUTDHSGANMHVIC-UHFFFAOYSA-N
Compound name
2-phenylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

2139
Patents

147.1048 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.11208 131.4
[M+Na]+ 170.09402 137.2
[M-H]- 146.09752 134.7
[M+NH4]+ 165.13862 152.0
[M+K]+ 186.06796 133.9
[M+H-H2O]+ 130.10206 124.5
[M+HCOO]- 192.10300 152.2
[M+CH3COO]- 206.11865 144.1
[M+Na-2H]- 168.07947 136.5
[M]+ 147.10425 125.6
[M]- 147.10535 125.6
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

patents stripe