CID 3040811

52963-49-2

Structural Information

Molecular Formula
C19H24N2
SMILES
CCN[C@@H]1CCN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H24N2/c1-2-20-18-13-14-21(15-18)19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18-20H,2,13-15H2,1H3/t18-/m1/s1
InChIKey
ZYLFUOYKGALLNE-GOSISDBHSA-N
Compound name
(3R)-1-benzhydryl-N-ethylpyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.19394 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.20122 168.0
[M+Na]+ 303.18316 171.3
[M-H]- 279.18666 175.3
[M+NH4]+ 298.22776 183.2
[M+K]+ 319.15710 166.4
[M+H-H2O]+ 263.19120 158.4
[M+HCOO]- 325.19214 188.7
[M+CH3COO]- 339.20779 178.1
[M+Na-2H]- 301.16861 169.7
[M]+ 280.19339 163.7
[M]- 280.19449 163.7
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.