CID 59465

102557-67-5

Structural Information

Molecular Formula
C22H26N2O
SMILES
CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(CN4CCCCC4)O
InChI
InChI=1S/C22H26N2O/c1-23-19-13-7-6-12-18(19)21(22(23)17-10-4-2-5-11-17)20(25)16-24-14-8-3-9-15-24/h2,4-7,10-13,20,25H,3,8-9,14-16H2,1H3
InChIKey
HTRCQBARWLWHGX-UHFFFAOYSA-N
Compound name
1-(1-methyl-2-phenylindol-3-yl)-2-piperidin-1-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.2045 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.21178 182.2
[M+Na]+ 357.19372 187.7
[M-H]- 333.19722 188.2
[M+NH4]+ 352.23832 194.7
[M+K]+ 373.16766 180.9
[M+H-H2O]+ 317.20176 171.9
[M+HCOO]- 379.20270 197.8
[M+CH3COO]- 393.21835 191.2
[M+Na-2H]- 355.17917 182.6
[M]+ 334.20395 179.1
[M]- 334.20505 179.1
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

No patent data available for this compound.