CID 3057974

1-(3-methyl-1-phenylbutyl)pyrrolidine hydrochloride

Structural Information

Molecular Formula
C15H23N
SMILES
CC(C)CC(C1=CC=CC=C1)N2CCCC2
InChI
InChI=1S/C15H23N/c1-13(2)12-15(16-10-6-7-11-16)14-8-4-3-5-9-14/h3-5,8-9,13,15H,6-7,10-12H2,1-2H3
InChIKey
LVSWGUYBWPLWKM-UHFFFAOYSA-N
Compound name
1-(3-methyl-1-phenylbutyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.18304 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.19032 154.8
[M+Na]+ 240.17226 165.8
[M+NH4]+ 235.21686 163.9
[M+K]+ 256.14620 160.3
[M-H]- 216.17576 158.4
[M+Na-2H]- 238.15771 161.4
[M]+ 217.18249 157.3
[M]- 217.18359 157.3
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.