CID 4525533

N-fmoc-freidinger's lactam

Structural Information

Molecular Formula
C24H26N2O5
SMILES
CC(C)C(C(=O)O)N1CCC(C1=O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C24H26N2O5/c1-14(2)21(23(28)29)26-12-11-20(22(26)27)25-24(30)31-13-19-17-9-5-3-7-15(17)16-8-4-6-10-18(16)19/h3-10,14,19-21H,11-13H2,1-2H3,(H,25,30)(H,28,29)
InChIKey
PEMHOAIHPQJNIM-UHFFFAOYSA-N
Compound name
2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-oxopyrrolidin-1-yl]-3-methylbutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

422.18417 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.191446 201.1
[M+Na]+ 445.173388 204.3
[M-H]- 421.176894 206.6
[M+NH4]+ 440.217993 213.6
[M+K]+ 461.147328 201.0
[M+H-H2O]+ 405.181430 193.9
[M+HCOO]- 467.182371 215.7
[M+CH3COO]- 481.198021 228.4
[M+Na-2H]- 443.158836 196.2
[M]+ 422.18362142 201.9
[M]- 422.18471858 201.9
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.