CID 6446491

(+-)-3-(6-(3-phenyl-2-propenyl)-6-azabicyclo(3.2.1)oct-1-yl)phenol hydrochloride

Structural Information

Molecular Formula
C22H25NO
SMILES
C1CC2CC(C1)(CN2C/C=C/C3=CC=CC=C3)C4=CC(=CC=C4)O
InChI
InChI=1S/C22H25NO/c24-21-12-4-10-19(15-21)22-13-5-11-20(16-22)23(17-22)14-6-9-18-7-2-1-3-8-18/h1-4,6-10,12,15,20,24H,5,11,13-14,16-17H2/b9-6+
InChIKey
UCEIGBSFUNGPSK-RMKNXTFCSA-N
Compound name
3-[6-[(E)-3-phenylprop-2-enyl]-6-azabicyclo[3.2.1]octan-1-yl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

319.1936 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.20088 181.1
[M+Na]+ 342.18282 194.3
[M+NH4]+ 337.22742 192.0
[M+K]+ 358.15676 184.2
[M-H]- 318.18632 186.4
[M+Na-2H]- 340.16827 188.9
[M]+ 319.19305 184.7
[M]- 319.19415 184.7
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.