CID 2735598
19-bromononadecanoic acid
Structural Information
- Molecular Formula
- C19H37BrO2
- SMILES
- C(CCCCCCCCCBr)CCCCCCCCC(=O)O
- InChI
- InChI=1S/C19H37BrO2/c20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19(21)22/h1-18H2,(H,21,22)
- InChIKey
- FLMPHTLDVWMADF-UHFFFAOYSA-N
- Compound name
- 19-bromononadecanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 377.20498 | 194.1 |
[M+Na]+ | 399.18692 | 199.0 |
[M-H]- | 375.19042 | 193.2 |
[M+NH4]+ | 394.23152 | 209.3 |
[M+K]+ | 415.16086 | 185.4 |
[M+H-H2O]+ | 359.19496 | 192.2 |
[M+HCOO]- | 421.19590 | 209.3 |
[M+CH3COO]- | 435.21155 | 215.5 |
[M+Na-2H]- | 397.17237 | 193.4 |
[M]+ | 376.19715 | 217.6 |
[M]- | 376.19825 | 217.6 |
Literature stripe
No literature data available for this compound.