CID 2756096

Fmoc-aib-oh

Structural Information

Molecular Formula
C19H19NO4
SMILES
CC(C)(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C19H19NO4/c1-19(2,17(21)22)20-18(23)24-11-16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h3-10,16H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKey
HOZZVEPRYYCBTO-UHFFFAOYSA-N
Compound name
2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2091
Patents

325.1314 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.13868 174.9
[M+Na]+ 348.12062 184.7
[M+NH4]+ 343.16522 181.6
[M+K]+ 364.09456 181.6
[M-H]- 324.12412 175.7
[M+Na-2H]- 346.10607 178.2
[M]+ 325.13085 176.3
[M]- 325.13195 176.3
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