CID 47002460
3-(3-methoxypropoxy)benzaldehyde
Structural Information
- Molecular Formula
- C11H14O3
- SMILES
- COCCCOC1=CC=CC(=C1)C=O
- InChI
- InChI=1S/C11H14O3/c1-13-6-3-7-14-11-5-2-4-10(8-11)9-12/h2,4-5,8-9H,3,6-7H2,1H3
- InChIKey
- FBINSGQXGIWVAH-UHFFFAOYSA-N
- Compound name
- 3-(3-methoxypropoxy)benzaldehyde
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 195.10158 | 140.7 |
[M+Na]+ | 217.08352 | 148.4 |
[M-H]- | 193.08702 | 144.3 |
[M+NH4]+ | 212.12812 | 160.3 |
[M+K]+ | 233.05746 | 147.0 |
[M+H-H2O]+ | 177.09156 | 134.5 |
[M+HCOO]- | 239.09250 | 165.5 |
[M+CH3COO]- | 253.10815 | 183.7 |
[M+Na-2H]- | 215.06897 | 147.2 |
[M]+ | 194.09375 | 145.4 |
[M]- | 194.09485 | 145.4 |
Literature stripe
No literature data available for this compound.