CID 51340600

(2s)-3-[(tert-butyldimethylsilyl)oxy]-2-{[(9h-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid

Structural Information

Molecular Formula
C24H31NO5Si
SMILES
CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C24H31NO5Si/c1-24(2,3)31(4,5)30-15-21(22(26)27)25-23(28)29-14-20-18-12-8-6-10-16(18)17-11-7-9-13-19(17)20/h6-13,20-21H,14-15H2,1-5H3,(H,25,28)(H,26,27)/t21-/m0/s1
InChIKey
IONOZYFSQPGBAT-NRFANRHFSA-N
Compound name
(2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

441.19714 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 442.20442 207.4
[M+Na]+ 464.18636 210.3
[M-H]- 440.18986 210.3
[M+NH4]+ 459.23096 219.8
[M+K]+ 480.16030 208.0
[M+H-H2O]+ 424.19440 201.0
[M+HCOO]- 486.19534 221.2
[M+CH3COO]- 500.21099 229.4
[M+Na-2H]- 462.17181 208.9
[M]+ 441.19659 212.0
[M]- 441.19769 212.0
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