CID 3072419

(s)-1-phenyl-n-(2-phenylethyl)-2-pyrrolidinemethanamine fumarate

Structural Information

Molecular Formula
C19H24N2
SMILES
C1C[C@H](N(C1)C2=CC=CC=C2)CNCCC3=CC=CC=C3
InChI
InChI=1S/C19H24N2/c1-3-8-17(9-4-1)13-14-20-16-19-12-7-15-21(19)18-10-5-2-6-11-18/h1-6,8-11,19-20H,7,12-16H2/t19-/m0/s1
InChIKey
DMGGXWHSHKTGCJ-IBGZPJMESA-N
Compound name
2-phenyl-N-[[(2S)-1-phenylpyrrolidin-2-yl]methyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.19394 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.20122 170.9
[M+Na]+ 303.18316 183.8
[M+NH4]+ 298.22776 180.2
[M+K]+ 319.15710 175.9
[M-H]- 279.18666 177.8
[M+Na-2H]- 301.16861 180.7
[M]+ 280.19339 174.7
[M]- 280.19449 174.7
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.