CID 483578

1-[(1r,2r,4r)-6-amino-1,4-bis[[tert-butyl(dimethyl)silyl]oxy]-8,8-dioxo-3,9-dioxa-8$l^{6}-thiaspiro[4.4]non-6-en-2-yl]-5-ethyl-pyrimidine-2,4-dione

Structural Information

Molecular Formula
C24H43N3O8SSi2
SMILES
CCC1=CN(C(=O)NC1=O)[C@H]2[C@@H](C3([C@H](O2)O[Si](C)(C)C(C)(C)C)C(=CS(=O)(=O)O3)N)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C24H43N3O8SSi2/c1-12-15-13-27(21(29)26-18(15)28)19-17(33-37(8,9)22(2,3)4)24(16(25)14-36(30,31)35-24)20(32-19)34-38(10,11)23(5,6)7/h13-14,17,19-20H,12,25H2,1-11H3,(H,26,28,29)/t17-,19+,20+,24?/m0/s1
InChIKey
CJIKTZASFNAQSO-LVXUHDSZSA-N
Compound name
1-[(6R,8R,9R)-4-amino-6,9-bis[[tert-butyl(dimethyl)silyl]oxy]-2,2-dioxo-1,7-dioxa-2lambda6-thiaspiro[4.4]non-3-en-8-yl]-5-ethylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

589.23096 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 590.23824 225.6
[M+Na]+ 612.22018 231.9
[M-H]- 588.22368 231.8
[M+NH4]+ 607.26478 232.8
[M+K]+ 628.19412 233.3
[M+H-H2O]+ 572.22822 224.0
[M+HCOO]- 634.22916 230.2
[M+CH3COO]- 648.24481 249.7
[M+Na-2H]- 610.20563 230.9
[M]+ 589.23041 235.5
[M]- 589.23151 235.5
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

No patent data available for this compound.