CID 10640670

Fmoc-n-(allyl)-glycine

Structural Information

Molecular Formula
C20H19NO4
SMILES
C=CCN(CC(=O)O)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C20H19NO4/c1-2-11-21(12-19(22)23)20(24)25-13-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h2-10,18H,1,11-13H2,(H,22,23)
InChIKey
NVNQGCMKCQZFSM-UHFFFAOYSA-N
Compound name
2-[9H-fluoren-9-ylmethoxycarbonyl(prop-2-enyl)amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

96
Patents

337.1314 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.13868 179.7
[M+Na]+ 360.12062 185.3
[M-H]- 336.12412 184.6
[M+NH4]+ 355.16522 196.4
[M+K]+ 376.09456 181.7
[M+H-H2O]+ 320.12866 172.6
[M+HCOO]- 382.12960 200.2
[M+CH3COO]- 396.14525 213.7
[M+Na-2H]- 358.10607 181.4
[M]+ 337.13085 183.3
[M]- 337.13195 183.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe