CID 95541
63867-16-3
Structural Information
- Molecular Formula
- C11H20O3
- SMILES
- CCCC(=O)OCCCC1CCCO1
- InChI
- InChI=1S/C11H20O3/c1-2-5-11(12)14-9-4-7-10-6-3-8-13-10/h10H,2-9H2,1H3
- InChIKey
- BAEVROZWRARQSZ-UHFFFAOYSA-N
- Compound name
- 3-(oxolan-2-yl)propyl butanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 201.14853 | 148.6 |
[M+Na]+ | 223.13047 | 153.1 |
[M-H]- | 199.13397 | 151.6 |
[M+NH4]+ | 218.17507 | 168.0 |
[M+K]+ | 239.10441 | 153.5 |
[M+H-H2O]+ | 183.13851 | 142.9 |
[M+HCOO]- | 245.13945 | 169.2 |
[M+CH3COO]- | 259.15510 | 183.5 |
[M+Na-2H]- | 221.11592 | 151.2 |
[M]+ | 200.14070 | 150.6 |
[M]- | 200.14180 | 150.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.