CID 132349294

2137443-10-6

Structural Information

Molecular Formula
C24H26N2O5
SMILES
CC(C(=O)N1CCCC(C1)C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C24H26N2O5/c1-15(22(27)26-12-6-7-16(13-26)23(28)29)25-24(30)31-14-21-19-10-4-2-8-17(19)18-9-3-5-11-20(18)21/h2-5,8-11,15-16,21H,6-7,12-14H2,1H3,(H,25,30)(H,28,29)
InChIKey
IGQNDNHOEVYVSD-UHFFFAOYSA-N
Compound name
1-[2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]piperidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

422.18417 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.19145 199.0
[M+Na]+ 445.17339 200.7
[M-H]- 421.17689 203.3
[M+NH4]+ 440.21799 209.3
[M+K]+ 461.14733 197.2
[M+H-H2O]+ 405.18143 190.3
[M+HCOO]- 467.18237 211.3
[M+CH3COO]- 481.19802 227.1
[M+Na-2H]- 443.15884 196.5
[M]+ 422.18362 196.9
[M]- 422.18472 196.9
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.