CID 454307

Nh2-acyclot deriv.

Structural Information

Molecular Formula
C17H33N3O4Si
SMILES
CC1=CN(C(=O)NC1=O)COC(CN)CO[Si](C)(C)C(C)(C)C(C)C
InChI
InChI=1S/C17H33N3O4Si/c1-12(2)17(4,5)25(6,7)24-10-14(8-18)23-11-20-9-13(3)15(21)19-16(20)22/h9,12,14H,8,10-11,18H2,1-7H3,(H,19,21,22)
InChIKey
MTLDJHNGNBRITO-UHFFFAOYSA-N
Compound name
1-[[1-amino-3-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxypropan-2-yl]oxymethyl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.22403 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.23131 189.4
[M+Na]+ 394.21325 194.6
[M-H]- 370.21675 188.3
[M+NH4]+ 389.25785 198.8
[M+K]+ 410.18719 192.4
[M+H-H2O]+ 354.22129 181.8
[M+HCOO]- 416.22223 203.1
[M+CH3COO]- 430.23788 218.7
[M+Na-2H]- 392.19870 189.5
[M]+ 371.22348 193.1
[M]- 371.22458 193.1
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.