CID 90793
22499-11-2
Structural Information
- Molecular Formula
- C18H20O2
- SMILES
- CCCCOC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
- InChI
- InChI=1S/C18H20O2/c1-2-3-14-20-18(16-12-8-5-9-13-16)17(19)15-10-6-4-7-11-15/h4-13,18H,2-3,14H2,1H3
- InChIKey
- DZZAHLOABNWIFA-UHFFFAOYSA-N
- Compound name
- 2-butoxy-1,2-diphenylethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 269.15361 | 164.7 |
[M+Na]+ | 291.13555 | 169.2 |
[M-H]- | 267.13905 | 170.4 |
[M+NH4]+ | 286.18015 | 180.3 |
[M+K]+ | 307.10949 | 165.8 |
[M+H-H2O]+ | 251.14359 | 156.5 |
[M+HCOO]- | 313.14453 | 186.3 |
[M+CH3COO]- | 327.16018 | 198.9 |
[M+Na-2H]- | 289.12100 | 168.1 |
[M]+ | 268.14578 | 166.0 |
[M]- | 268.14688 | 166.0 |