CID 139596320
Ns00018905
Structural Information
- Molecular Formula
- C11H13F13N2O3S
- SMILES
- CCN(CCCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
- InChI
- InChI=1S/C11H13F13N2O3S/c1-2-26(27)5-3-4-25-30(28,29)11(23,24)9(18,19)7(14,15)6(12,13)8(16,17)10(20,21)22/h25,27H,2-5H2,1H3
- InChIKey
- NVYLHMDYIJBZAY-UHFFFAOYSA-N
- Compound name
- N-[3-[ethyl(hydroxy)amino]propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 501.05118 | 174.5 |
[M+Na]+ | 523.03312 | 180.9 |
[M-H]- | 499.03662 | 182.2 |
[M+NH4]+ | 518.07772 | 182.5 |
[M+K]+ | 539.00706 | 185.8 |
[M+H-H2O]+ | 483.04116 | 163.8 |
[M+HCOO]- | 545.04210 | 190.1 |
[M+CH3COO]- | 559.05775 | 238.6 |
[M+Na-2H]- | 521.01857 | 171.1 |
[M]+ | 500.04335 | 172.1 |
[M]- | 500.04445 | 172.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.