CID 48522
2,4,6(1h,3h,5h)-pyrimidinetrione, 5-butyl-5-(2-propenyl)-
Structural Information
- Molecular Formula
- C11H16N2O3
- SMILES
- CCCCC1(C(=O)NC(=O)NC1=O)CC=C
- InChI
- InChI=1S/C11H16N2O3/c1-3-5-7-11(6-4-2)8(14)12-10(16)13-9(11)15/h4H,2-3,5-7H2,1H3,(H2,12,13,14,15,16)
- InChIKey
- RRWVWLGUQPLOMY-UHFFFAOYSA-N
- Compound name
- 5-butyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 225.12337 | 150.2 |
[M+Na]+ | 247.10531 | 157.6 |
[M-H]- | 223.10881 | 148.0 |
[M+NH4]+ | 242.14991 | 166.6 |
[M+K]+ | 263.07925 | 153.4 |
[M+H-H2O]+ | 207.11335 | 144.5 |
[M+HCOO]- | 269.11429 | 165.5 |
[M+CH3COO]- | 283.12994 | 184.6 |
[M+Na-2H]- | 245.09076 | 152.8 |
[M]+ | 224.11554 | 146.9 |
[M]- | 224.11664 | 146.9 |