CID 103666210

2137488-99-2

Structural Information

Molecular Formula
C21H24N2O4
SMILES
CN(C)CCC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C21H24N2O4/c1-23(2)12-11-19(20(24)25)22-21(26)27-13-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h3-10,18-19H,11-13H2,1-2H3,(H,22,26)(H,24,25)
InChIKey
MDSKSOAVAVTJHJ-UHFFFAOYSA-N
Compound name
4-(dimethylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

368.1736 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.18088 187.7
[M+Na]+ 391.16282 195.8
[M+NH4]+ 386.20742 193.7
[M+K]+ 407.13676 192.7
[M-H]- 367.16632 189.2
[M+Na-2H]- 389.14827 189.9
[M]+ 368.17305 188.8
[M]- 368.17415 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.