CID 19177840
2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-n-(3-methoxyphenyl)heptanamide
Structural Information
- Molecular Formula
- C14H8F13NO2
- SMILES
- COC1=CC=CC(=C1)NC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
- InChI
- InChI=1S/C14H8F13NO2/c1-30-7-4-2-3-6(5-7)28-8(29)9(15,16)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)27/h2-5H,1H3,(H,28,29)
- InChIKey
- ALGOLQFPMNZMNC-UHFFFAOYSA-N
- Compound name
- 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N-(3-methoxyphenyl)heptanamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 470.04204 | 192.1 |
[M+Na]+ | 492.02398 | 200.5 |
[M-H]- | 468.02748 | 180.8 |
[M+NH4]+ | 487.06858 | 199.2 |
[M+K]+ | 507.99792 | 196.3 |
[M+H-H2O]+ | 452.03202 | 176.8 |
[M+HCOO]- | 514.03296 | 192.3 |
[M+CH3COO]- | 528.04861 | 234.0 |
[M+Na-2H]- | 490.00943 | 194.5 |
[M]+ | 469.03421 | 173.5 |
[M]- | 469.03531 | 173.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.