CID 3057980

1-(1-phenylpentyl)pyrrolidine hydrochloride

Structural Information

Molecular Formula
C15H23N
SMILES
CCCCC(C1=CC=CC=C1)N2CCCC2
InChI
InChI=1S/C15H23N/c1-2-3-11-15(16-12-7-8-13-16)14-9-5-4-6-10-14/h4-6,9-10,15H,2-3,7-8,11-13H2,1H3
InChIKey
IOZMHEDSUZBONO-UHFFFAOYSA-N
Compound name
1-(1-phenylpentyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.18304 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.19032 154.5
[M+Na]+ 240.17226 158.2
[M-H]- 216.17576 158.4
[M+NH4]+ 235.21686 172.9
[M+K]+ 256.14620 155.1
[M+H-H2O]+ 200.18030 146.4
[M+HCOO]- 262.18124 174.1
[M+CH3COO]- 276.19689 189.2
[M+Na-2H]- 238.15771 156.1
[M]+ 217.18249 151.7
[M]- 217.18359 151.7
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.