CID 79753
Acetaldehyde di-isobutylacetal
Structural Information
- Molecular Formula
- C10H22O2
- SMILES
- CC(C)COC(C)OCC(C)C
- InChI
- InChI=1S/C10H22O2/c1-8(2)6-11-10(5)12-7-9(3)4/h8-10H,6-7H2,1-5H3
- InChIKey
- KIELJSVPUISYCI-UHFFFAOYSA-N
- Compound name
- 2-methyl-1-[1-(2-methylpropoxy)ethoxy]propane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 175.16927 | 144.3 |
[M+Na]+ | 197.15121 | 149.3 |
[M-H]- | 173.15471 | 144.2 |
[M+NH4]+ | 192.19581 | 164.7 |
[M+K]+ | 213.12515 | 150.3 |
[M+H-H2O]+ | 157.15925 | 139.3 |
[M+HCOO]- | 219.16019 | 164.3 |
[M+CH3COO]- | 233.17584 | 185.8 |
[M+Na-2H]- | 195.13666 | 145.5 |
[M]+ | 174.16144 | 148.1 |
[M]- | 174.16254 | 148.1 |