CID 214081

27674-56-2

Structural Information

Molecular Formula
C22H29NO2
SMILES
COCC(CN1CCCCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C22H29NO2/c1-25-18-21(17-23-15-9-4-10-16-23)22(24,19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-3,5-8,11-14,21,24H,4,9-10,15-18H2,1H3
InChIKey
CQAMWRIKNBFSGL-UHFFFAOYSA-N
Compound name
2-(methoxymethyl)-1,1-diphenyl-3-piperidin-1-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.21982 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.227096 184.3
[M+Na]+ 362.209038 184.9
[M-H]- 338.212544 188.9
[M+NH4]+ 357.253643 194.1
[M+K]+ 378.182978 180.2
[M+H-H2O]+ 322.217080 174.1
[M+HCOO]- 384.218021 197.7
[M+CH3COO]- 398.233671 208.3
[M+Na-2H]- 360.194486 186.7
[M]+ 339.21927142 179.3
[M]- 339.22036858 179.3
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.