CID 137700020

2306827-13-2

Structural Information

Molecular Formula
C24H30N2O2
SMILES
C1CN(CCC1N(C2=CC=CC=C2)C(=O)C3CCOC3)CCC4=CC=CC=C4
InChI
InChI=1S/C24H30N2O2/c27-24(21-14-18-28-19-21)26(22-9-5-2-6-10-22)23-12-16-25(17-13-23)15-11-20-7-3-1-4-8-20/h1-10,21,23H,11-19H2
InChIKey
IYRYSBGEQAGZME-UHFFFAOYSA-N
Compound name
N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]oxolane-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.23074 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.238016 193.3
[M+Na]+ 401.219958 192.8
[M-H]- 377.223464 204.0
[M+NH4]+ 396.264563 202.5
[M+K]+ 417.193898 189.8
[M+H-H2O]+ 361.228000 181.8
[M+HCOO]- 423.228941 209.2
[M+CH3COO]- 437.244591 200.7
[M+Na-2H]- 399.205406 191.3
[M]+ 378.23019142 187.4
[M]- 378.23128858 187.4
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.