CID 213108

25501-35-3

Structural Information

Molecular Formula
C22H29NO2
SMILES
CCN(CC)CC(C)OC(=O)C(C)(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C22H29NO2/c1-5-23(6-2)17-18(3)25-21(24)22(4,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7-16,18H,5-6,17H2,1-4H3
InChIKey
CKCSRNQAOJMTBX-UHFFFAOYSA-N
Compound name
1-(diethylamino)propan-2-yl 2,2-diphenylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.21982 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.22710 186.1
[M+Na]+ 362.20904 188.5
[M-H]- 338.21254 192.7
[M+NH4]+ 357.25364 199.2
[M+K]+ 378.18298 186.2
[M+H-H2O]+ 322.21708 177.1
[M+HCOO]- 384.21802 206.3
[M+CH3COO]- 398.23367 218.8
[M+Na-2H]- 360.19449 187.8
[M]+ 339.21927 188.8
[M]- 339.22037 188.8
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.