CID 132350903

2137134-93-9

Structural Information

Molecular Formula
C21H21NO4
SMILES
CN(C1CC(C1)C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C21H21NO4/c1-22(14-10-13(11-14)20(23)24)21(25)26-12-19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,13-14,19H,10-12H2,1H3,(H,23,24)
InChIKey
GLSVOHJKRSMNST-UHFFFAOYSA-N
Compound name
3-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.14706 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.15434 182.3
[M+Na]+ 374.13628 185.6
[M-H]- 350.13978 189.9
[M+NH4]+ 369.18088 191.6
[M+K]+ 390.11022 186.2
[M+H-H2O]+ 334.14432 169.3
[M+HCOO]- 396.14526 200.0
[M+CH3COO]- 410.16091 219.4
[M+Na-2H]- 372.12173 181.9
[M]+ 351.14651 192.6
[M]- 351.14761 192.6
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.