CID 152540090

Fmoc-l-ala(bcp)-oh

Structural Information

Molecular Formula
C23H23NO4
SMILES
C1C2CC1(C2)C[C@@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35
InChI
InChI=1S/C23H23NO4/c25-21(26)20(12-23-9-14(10-23)11-23)24-22(27)28-13-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,14,19-20H,9-13H2,(H,24,27)(H,25,26)/t14?,20-,23?/m0/s1
InChIKey
YLJCOQFCQRLDIZ-UTHVCPNDSA-N
Compound name
(2S)-3-(1-bicyclo[1.1.1]pentanyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

377.16272 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.17000 194.5
[M+Na]+ 400.15194 191.1
[M+NH4]+ 395.19654 192.3
[M+K]+ 416.12588 190.0
[M-H]- 376.15544 188.6
[M+Na-2H]- 398.13739 188.2
[M]+ 377.16217 189.5
[M]- 377.16327 189.5
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