CID 204386

Diphenylprolinol

Structural Information

Molecular Formula
C17H19NO
SMILES
C1CC(NC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C17H19NO/c19-17(16-12-7-13-18-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,16,18-19H,7,12-13H2
InChIKey
OGCGXUGBDJGFFY-UHFFFAOYSA-N
Compound name
diphenyl(pyrrolidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

37
References

1558
Patents

253.14667 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.153946 159.2
[M+Na]+ 276.135888 163.2
[M-H]- 252.139394 164.1
[M+NH4]+ 271.180493 174.3
[M+K]+ 292.109828 157.6
[M+H-H2O]+ 236.143930 151.2
[M+HCOO]- 298.144871 176.2
[M+CH3COO]- 312.160521 169.2
[M+Na-2H]- 274.121336 163.3
[M]+ 253.14612142 152.4
[M]- 253.14721858 152.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe