CID 454611

148797-23-3

Structural Information

Molecular Formula
C23H28F2N2O4Si
SMILES
C[Si](C)(C)C[C@@H](C(=O)C(C(=O)NCC1=CC=CC=C1)(F)F)NC(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C23H28F2N2O4Si/c1-32(2,3)16-19(27-22(30)31-15-18-12-8-5-9-13-18)20(28)23(24,25)21(29)26-14-17-10-6-4-7-11-17/h4-13,19H,14-16H2,1-3H3,(H,26,29)(H,27,30)/t19-/m0/s1
InChIKey
ASOGAPFWVCBKBL-IBGZPJMESA-N
Compound name
benzyl N-[(2R)-5-(benzylamino)-4,4-difluoro-3,5-dioxo-1-trimethylsilylpentan-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

462.17865 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 463.18593 207.7
[M+Na]+ 485.16787 208.4
[M-H]- 461.17137 210.0
[M+NH4]+ 480.21247 214.9
[M+K]+ 501.14181 205.7
[M+H-H2O]+ 445.17591 196.8
[M+HCOO]- 507.17685 222.7
[M+CH3COO]- 521.19250 235.2
[M+Na-2H]- 483.15332 207.8
[M]+ 462.17810 206.4
[M]- 462.17920 206.4
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

No patent data available for this compound.