CID 6476961

Nsc685185

Structural Information

Molecular Formula
C26H46N2O7Si2
SMILES
CC1=CN(C(=O)N(C1=O)C)[C@H]2[C@@H](/C(=C/C(=O)OC)/[C@H](O2)CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C26H46N2O7Si2/c1-17-15-28(24(31)27(8)22(17)30)23-21(35-37(12,13)26(5,6)7)18(14-20(29)32-9)19(34-23)16-33-36(10,11)25(2,3)4/h14-15,19,21,23H,16H2,1-13H3/b18-14+/t19-,21-,23-/m1/s1
InChIKey
SJIASRYBWDNGHN-NCPFVHOFSA-N
Compound name
methyl (2E)-2-[(2S,4R,5R)-4-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(3,5-dimethyl-2,4-dioxopyrimidin-1-yl)oxolan-3-ylidene]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

554.28436 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 555.29164 225.3
[M+Na]+ 577.27358 230.9
[M-H]- 553.27708 230.3
[M+NH4]+ 572.31818 230.4
[M+K]+ 593.24752 231.2
[M+H-H2O]+ 537.28162 219.4
[M+HCOO]- 599.28256 233.8
[M+CH3COO]- 613.29821 250.2
[M+Na-2H]- 575.25903 224.8
[M]+ 554.28381 235.8
[M]- 554.28491 235.8
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.