CID 56935949
Myristoleyl arachidate
Structural Information
- Molecular Formula
- C34H66O2
- SMILES
- CCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCC/C=C\CCCC
- InChI
- InChI=1S/C34H66O2/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34(35)36-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h10,12H,3-9,11,13-33H2,1-2H3/b12-10-
- InChIKey
- NGFWMWUDSHTEQU-BENRWUELSA-N
- Compound name
- [(Z)-tetradec-9-enyl] icosanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 507.51358 | 244.9 |
[M+Na]+ | 529.49552 | 251.2 |
[M-H]- | 505.49902 | 226.7 |
[M+NH4]+ | 524.54012 | 243.6 |
[M+K]+ | 545.46946 | 251.1 |
[M+H-H2O]+ | 489.50356 | 244.7 |
[M+HCOO]- | 551.50450 | 253.6 |
[M+CH3COO]- | 565.52015 | 251.7 |
[M+Na-2H]- | 527.48097 | 229.9 |
[M]+ | 506.50575 | 245.6 |
[M]- | 506.50685 | 245.6 |
Literature stripe
No literature data available for this compound.