CID 201486

1,1-diphenyl-2-(pyrrolidin-1-yl)ethan-1-ol

Structural Information

Molecular Formula
C18H21NO
SMILES
C1CCN(C1)CC(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C18H21NO/c20-18(15-19-13-7-8-14-19,16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,20H,7-8,13-15H2
InChIKey
JLWRUIGVRORVHH-UHFFFAOYSA-N
Compound name
1,1-diphenyl-2-pyrrolidin-1-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

267.16232 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.169596 163.8
[M+Na]+ 290.151538 167.7
[M-H]- 266.155044 169.8
[M+NH4]+ 285.196143 179.0
[M+K]+ 306.125478 162.8
[M+H-H2O]+ 250.159580 155.2
[M+HCOO]- 312.160521 181.9
[M+CH3COO]- 326.176171 174.0
[M+Na-2H]- 288.136986 167.7
[M]+ 267.16177142 159.1
[M]- 267.16286858 159.1
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

patents stripe