CID 218323
1,1'-ethylenebis(3-(2-(amidinothio)ethyl)urea) dihydrochloride
Structural Information
- Molecular Formula
- C10H22N8O2S2
- SMILES
- C(CNC(=O)NCCSC(=N)N)NC(=O)NCCSC(=N)N
- InChI
- InChI=1S/C10H22N8O2S2/c11-7(12)21-5-3-17-9(19)15-1-2-16-10(20)18-4-6-22-8(13)14/h1-6H2,(H3,11,12)(H3,13,14)(H2,15,17,19)(H2,16,18,20)
- InChIKey
- IIAQEVQFHOXPMQ-UHFFFAOYSA-N
- Compound name
- 2-[2-(2-carbamimidoylsulfanylethylcarbamoylamino)ethylcarbamoylamino]ethyl carbamimidothioate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 351.13798 | 168.6 |
[M+Na]+ | 373.11992 | 166.5 |
[M-H]- | 349.12342 | 165.2 |
[M+NH4]+ | 368.16452 | 177.7 |
[M+K]+ | 389.09386 | 162.2 |
[M+H-H2O]+ | 333.12796 | 157.8 |
[M+HCOO]- | 395.12890 | 181.8 |
[M+CH3COO]- | 409.14455 | 228.3 |
[M+Na-2H]- | 371.10537 | 168.1 |
[M]+ | 350.13015 | 161.9 |
[M]- | 350.13125 | 161.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.