CID 3072413

(-)-1-phenyl-n-(phenylmethyl)-2-pyrrolidinemethanamine fumarate

Structural Information

Molecular Formula
C18H22N2
SMILES
C1CC(N(C1)C2=CC=CC=C2)CNCC3=CC=CC=C3
InChI
InChI=1S/C18H22N2/c1-3-8-16(9-4-1)14-19-15-18-12-7-13-20(18)17-10-5-2-6-11-17/h1-6,8-11,18-19H,7,12-15H2
InChIKey
HVJFLJHRNSZSIX-UHFFFAOYSA-N
Compound name
N-benzyl-1-(1-phenylpyrrolidin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.17828 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.18556 166.4
[M+Na]+ 289.16750 179.5
[M+NH4]+ 284.21210 175.8
[M+K]+ 305.14144 171.8
[M-H]- 265.17100 173.3
[M+Na-2H]- 287.15295 176.4
[M]+ 266.17773 170.2
[M]- 266.17883 170.2
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.