CID 3033291
64038-17-1
Structural Information
- Molecular Formula
- C10H16N2O2S
- SMILES
- CCC1(C(=O)NC(=S)N(C1=O)C)C(C)C
- InChI
- InChI=1S/C10H16N2O2S/c1-5-10(6(2)3)7(13)11-9(15)12(4)8(10)14/h6H,5H2,1-4H3,(H,11,13,15)
- InChIKey
- RLVTYIDKMICCBU-UHFFFAOYSA-N
- Compound name
- 5-ethyl-1-methyl-5-propan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 229.10053 | 147.4 |
[M+Na]+ | 251.08247 | 155.8 |
[M-H]- | 227.08597 | 147.2 |
[M+NH4]+ | 246.12707 | 165.3 |
[M+K]+ | 267.05641 | 152.4 |
[M+H-H2O]+ | 211.09051 | 142.5 |
[M+HCOO]- | 273.09145 | 157.8 |
[M+CH3COO]- | 287.10710 | 188.7 |
[M+Na-2H]- | 249.06792 | 146.5 |
[M]+ | 228.09270 | 146.9 |
[M]- | 228.09380 | 146.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.