CID 470038

Tert-butyl-[[(4s,6r)-4-(2,6-dichloroimidazo[1,2-a]pyridin-5-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methoxy]-dimethyl-silane

Structural Information

Molecular Formula
C21H30Cl2N2O4Si
SMILES
CC1(OC2[C@H](O[C@H](C2O1)C3=C(C=CC4=NC(=CN43)Cl)Cl)CO[Si](C)(C)C(C)(C)C)C
InChI
InChI=1S/C21H30Cl2N2O4Si/c1-20(2,3)30(6,7)26-11-13-17-19(29-21(4,5)28-17)18(27-13)16-12(22)8-9-15-24-14(23)10-25(15)16/h8-10,13,17-19H,11H2,1-7H3/t13-,17?,18+,19?/m1/s1
InChIKey
PHTWGEJTDVVJAZ-AHAAGTOESA-N
Compound name
tert-butyl-[[(4S,6R)-4-(2,6-dichloroimidazo[1,2-a]pyridin-5-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methoxy]-dimethylsilane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

472.1352 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 473.14248 214.3
[M+Na]+ 495.12442 225.0
[M-H]- 471.12792 222.4
[M+NH4]+ 490.16902 228.0
[M+K]+ 511.09836 222.9
[M+H-H2O]+ 455.13246 210.8
[M+HCOO]- 517.13340 216.8
[M+CH3COO]- 531.14905 230.5
[M+Na-2H]- 493.10987 213.2
[M]+ 472.13465 225.8
[M]- 472.13575 225.8
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.