CID 465302

[3-(n-1-thyminyl)propyl]methylphenylsilanol

Structural Information

Molecular Formula
C15H20N2O3Si
SMILES
CC1=CN(C(=O)NC1=O)CCC[Si](C)(C2=CC=CC=C2)O
InChI
InChI=1S/C15H20N2O3Si/c1-12-11-17(15(19)16-14(12)18)9-6-10-21(2,20)13-7-4-3-5-8-13/h3-5,7-8,11,20H,6,9-10H2,1-2H3,(H,16,18,19)
InChIKey
JCUVMRIKDFFYMA-UHFFFAOYSA-N
Compound name
1-[3-(hydroxy-methyl-phenylsilyl)propyl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.12433 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.13161 169.8
[M+Na]+ 327.11355 178.1
[M-H]- 303.11705 171.5
[M+NH4]+ 322.15815 181.5
[M+K]+ 343.08749 172.6
[M+H-H2O]+ 287.12159 161.4
[M+HCOO]- 349.12253 187.0
[M+CH3COO]- 363.13818 197.2
[M+Na-2H]- 325.09900 174.4
[M]+ 304.12378 170.4
[M]- 304.12488 170.4
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.