CID 10109941

86925-99-7

Structural Information

Molecular Formula
C23H22N2O3
SMILES
C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C23H22N2O3/c26-22(24-20-13-12-18-9-4-5-10-19(18)15-20)21-11-6-14-25(21)23(27)28-16-17-7-2-1-3-8-17/h1-5,7-10,12-13,15,21H,6,11,14,16H2,(H,24,26)/t21-/m0/s1
InChIKey
JNQYOPCQZVPOCL-NRFANRHFSA-N
Compound name
benzyl (2S)-2-(naphthalen-2-ylcarbamoyl)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

374.16306 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.17034 190.8
[M+Na]+ 397.15228 203.1
[M+NH4]+ 392.19688 198.2
[M+K]+ 413.12622 197.2
[M-H]- 373.15578 196.5
[M+Na-2H]- 395.13773 198.6
[M]+ 374.16251 194.0
[M]- 374.16361 194.0
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

patents stripe