CID 384518

Nsc674469

Structural Information

Molecular Formula
C29H49N3O5SeSi2
SMILES
CC1=CN(C(=O)NC1=O)C2C(C(C(O2)CO[Si](C)(C)C(C)(C)C)N(C)O[Si](C)(C)C(C)(C)C)[Se]C3=CC=CC=C3
InChI
InChI=1S/C29H49N3O5SeSi2/c1-20-18-32(27(34)30-25(20)33)26-24(38-21-16-14-13-15-17-21)23(31(8)37-40(11,12)29(5,6)7)22(36-26)19-35-39(9,10)28(2,3)4/h13-18,22-24,26H,19H2,1-12H3,(H,30,33,34)
InChIKey
FANWTEHKYRHXQY-UHFFFAOYSA-N
Compound name
1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-[[tert-butyl(dimethyl)silyl]oxy-methylamino]-3-phenylselanyloxolan-2-yl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

655.2376 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 656.24488 252.9
[M+Na]+ 678.22682 255.1
[M-H]- 654.23032 259.7
[M+NH4]+ 673.27142 254.6
[M+K]+ 694.20076 254.0
[M+H-H2O]+ 638.23486 243.4
[M+HCOO]- 700.23580 260.6
[M+CH3COO]- 714.25145 262.3
[M+Na-2H]- 676.21227 251.2
[M]+ 655.23705 259.3
[M]- 655.23815 259.3
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.