CID 199422

4151-00-2

Structural Information

Molecular Formula
C19H24N2O
SMILES
CC(CN1CCCC1)C(C2=CC=CC=C2)(C3=CC=CC=N3)O
InChI
InChI=1S/C19H24N2O/c1-16(15-21-13-7-8-14-21)19(22,17-9-3-2-4-10-17)18-11-5-6-12-20-18/h2-6,9-12,16,22H,7-8,13-15H2,1H3
InChIKey
VBTFCCSRDNNZLY-UHFFFAOYSA-N
Compound name
2-methyl-1-phenyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.18887 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.196146 172.3
[M+Na]+ 319.178088 175.4
[M-H]- 295.181594 176.8
[M+NH4]+ 314.222693 184.8
[M+K]+ 335.152028 170.6
[M+H-H2O]+ 279.186130 162.6
[M+HCOO]- 341.187071 187.7
[M+CH3COO]- 355.202721 199.4
[M+Na-2H]- 317.163536 174.6
[M]+ 296.18832142 167.8
[M]- 296.18941858 167.8
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.