CID 2756128

4-(((9h-fluoren-9-yl)methoxy)carbonyl)morpholine-2-carboxylic acid

Structural Information

Molecular Formula
C20H19NO5
SMILES
C1COC(CN1C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O
InChI
InChI=1S/C20H19NO5/c22-19(23)18-11-21(9-10-25-18)20(24)26-12-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,17-18H,9-12H2,(H,22,23)
InChIKey
TUZVFPRISNDQLQ-UHFFFAOYSA-N
Compound name
4-(9H-fluoren-9-ylmethoxycarbonyl)morpholine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

353.1263 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.133576 180.5
[M+Na]+ 376.115518 185.7
[M-H]- 352.119024 186.2
[M+NH4]+ 371.160123 193.1
[M+K]+ 392.089458 182.9
[M+H-H2O]+ 336.123560 172.3
[M+HCOO]- 398.124501 194.2
[M+CH3COO]- 412.140151 189.8
[M+Na-2H]- 374.100966 181.7
[M]+ 353.12575142 180.3
[M]- 353.12684858 180.3
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