CID 131799541
Dg(i-16:0/0:0/i-13:0)
Structural Information
- Molecular Formula
- C32H62O5
- SMILES
- CC(C)CCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCC(C)C)O
- InChI
- InChI=1S/C32H62O5/c1-28(2)22-18-14-10-7-5-6-8-12-16-20-24-31(34)36-26-30(33)27-37-32(35)25-21-17-13-9-11-15-19-23-29(3)4/h28-30,33H,5-27H2,1-4H3/t30-/m1/s1
- InChIKey
- AEIONZPJIHVANG-SSEXGKCCSA-N
- Compound name
- [(2R)-2-hydroxy-3-(11-methyldodecanoyloxy)propyl] 14-methylpentadecanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 527.46698 | 241.5 |
[M+Na]+ | 549.44892 | 247.7 |
[M-H]- | 525.45242 | 231.9 |
[M+NH4]+ | 544.49352 | 246.7 |
[M+K]+ | 565.42286 | 248.7 |
[M+H-H2O]+ | 509.45696 | 243.2 |
[M+HCOO]- | 571.45790 | 240.1 |
[M+CH3COO]- | 585.47355 | 251.5 |
[M+Na-2H]- | 547.43437 | 228.1 |
[M]+ | 526.45915 | 241.4 |
[M]- | 526.46025 | 241.4 |
Literature stripe
Patent stripe
No patent data available for this compound.