CID 88555
2,3,5-trimethylanisole
Structural Information
- Molecular Formula
- C10H14O
- SMILES
- CC1=CC(=C(C(=C1)OC)C)C
- InChI
- InChI=1S/C10H14O/c1-7-5-8(2)9(3)10(6-7)11-4/h5-6H,1-4H3
- InChIKey
- AWONIZVBKXHWJP-UHFFFAOYSA-N
- Compound name
- 1-methoxy-2,3,5-trimethylbenzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 151.11174 | 129.0 |
[M+Na]+ | 173.09368 | 138.9 |
[M-H]- | 149.09718 | 133.7 |
[M+NH4]+ | 168.13828 | 151.4 |
[M+K]+ | 189.06762 | 137.6 |
[M+H-H2O]+ | 133.10172 | 124.2 |
[M+HCOO]- | 195.10266 | 153.6 |
[M+CH3COO]- | 209.11831 | 179.9 |
[M+Na-2H]- | 171.07913 | 134.9 |
[M]+ | 150.10391 | 132.0 |
[M]- | 150.10501 | 132.0 |