CID 48243

66902-40-7

Structural Information

Molecular Formula
C23H29NO2
SMILES
CC(CC1CCCCN1C)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H29NO2/c1-18(17-21-15-9-10-16-24(21)2)26-23(25)22(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-8,11-14,18,21-22H,9-10,15-17H2,1-2H3
InChIKey
FTMNELFPMQUJAE-UHFFFAOYSA-N
Compound name
1-(1-methylpiperidin-2-yl)propan-2-yl 2,2-diphenylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.21982 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.22710 188.1
[M+Na]+ 374.20904 189.0
[M-H]- 350.21254 194.2
[M+NH4]+ 369.25364 198.2
[M+K]+ 390.18298 184.9
[M+H-H2O]+ 334.21708 177.4
[M+HCOO]- 396.21802 202.5
[M+CH3COO]- 410.23367 214.7
[M+Na-2H]- 372.19449 186.5
[M]+ 351.21927 184.2
[M]- 351.22037 184.2
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.