CID 118879
35840-23-4
Structural Information
- Molecular Formula
- C18H20O3
- SMILES
- CCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC
- InChI
- InChI=1S/C18H20O3/c1-3-4-5-14-6-10-17(11-7-14)21-18(19)15-8-12-16(20-2)13-9-15/h6-13H,3-5H2,1-2H3
- InChIKey
- IRZMTHPYWFFQMC-UHFFFAOYSA-N
- Compound name
- (4-butylphenyl) 4-methoxybenzoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 285.14852 | 167.3 |
[M+Na]+ | 307.13046 | 181.5 |
[M+NH4]+ | 302.17506 | 175.2 |
[M+K]+ | 323.10440 | 173.5 |
[M-H]- | 283.13396 | 171.5 |
[M+Na-2H]- | 305.11591 | 175.8 |
[M]+ | 284.14069 | 170.6 |
[M]- | 284.14179 | 170.6 |
Literature stripe
No literature data available for this compound.