CID 212074
5-(p-(trimethylsilyl)benzyl)-5-ethylbarbituric acid
Structural Information
- Molecular Formula
- C16H22N2O3Si
- SMILES
- CCC1(C(=O)NC(=O)NC1=O)CC2=CC=C(C=C2)[Si](C)(C)C
- InChI
- InChI=1S/C16H22N2O3Si/c1-5-16(13(19)17-15(21)18-14(16)20)10-11-6-8-12(9-7-11)22(2,3)4/h6-9H,5,10H2,1-4H3,(H2,17,18,19,20,21)
- InChIKey
- VOJCHYOLAZUFBU-UHFFFAOYSA-N
- Compound name
- 5-ethyl-5-[(4-trimethylsilylphenyl)methyl]-1,3-diazinane-2,4,6-trione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 319.14726 | 174.4 |
[M+Na]+ | 341.12920 | 181.4 |
[M-H]- | 317.13270 | 175.5 |
[M+NH4]+ | 336.17380 | 187.5 |
[M+K]+ | 357.10314 | 176.3 |
[M+H-H2O]+ | 301.13724 | 167.1 |
[M+HCOO]- | 363.13818 | 187.2 |
[M+CH3COO]- | 377.15383 | 201.1 |
[M+Na-2H]- | 339.11465 | 176.4 |
[M]+ | 318.13943 | 171.3 |
[M]- | 318.14053 | 171.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.