CID 62308
3-methoxy-3-methylbutyl acetate
Structural Information
- Molecular Formula
- C8H16O3
- SMILES
- CC(=O)OCCC(C)(C)OC
- InChI
- InChI=1S/C8H16O3/c1-7(9)11-6-5-8(2,3)10-4/h5-6H2,1-4H3
- InChIKey
- RYNQKSJRFHJZTK-UHFFFAOYSA-N
- Compound name
- (3-methoxy-3-methylbutyl) acetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 161.11722 | 135.3 |
[M+Na]+ | 183.09916 | 142.4 |
[M-H]- | 159.10266 | 135.7 |
[M+NH4]+ | 178.14376 | 156.5 |
[M+K]+ | 199.07310 | 143.3 |
[M+H-H2O]+ | 143.10720 | 131.1 |
[M+HCOO]- | 205.10814 | 157.0 |
[M+CH3COO]- | 219.12379 | 178.7 |
[M+Na-2H]- | 181.08461 | 141.0 |
[M]+ | 160.10939 | 139.9 |
[M]- | 160.11049 | 139.9 |
Literature stripe
No literature data available for this compound.