CID 205861

18872-47-4

Structural Information

Molecular Formula
C20H23NO
SMILES
C=C(CN1CCCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C20H23NO/c1-17(16-21-14-8-9-15-21)20(22,18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-7,10-13,22H,1,8-9,14-16H2
InChIKey
UGGBZYZHDQHXIO-UHFFFAOYSA-N
Compound name
1,1-diphenyl-2-(pyrrolidin-1-ylmethyl)prop-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.17798 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.18526 172.0
[M+Na]+ 316.16720 175.0
[M-H]- 292.17070 177.7
[M+NH4]+ 311.21180 185.9
[M+K]+ 332.14114 169.5
[M+H-H2O]+ 276.17524 163.2
[M+HCOO]- 338.17618 188.5
[M+CH3COO]- 352.19183 198.9
[M+Na-2H]- 314.15265 173.7
[M]+ 293.17743 166.6
[M]- 293.17853 166.6
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