CID 3062450
3,4-dihydroxy-n-(3-phenylpropyl)benzamide
Structural Information
- Molecular Formula
- C16H17NO3
- SMILES
- C1=CC=C(C=C1)CCCNC(=O)C2=CC(=C(C=C2)O)O
- InChI
- InChI=1S/C16H17NO3/c18-14-9-8-13(11-15(14)19)16(20)17-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11,18-19H,4,7,10H2,(H,17,20)
- InChIKey
- DZSCQOOBZCMOKC-UHFFFAOYSA-N
- Compound name
- 3,4-dihydroxy-N-(3-phenylpropyl)benzamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 272.12813 | 162.2 |
[M+Na]+ | 294.11007 | 167.9 |
[M-H]- | 270.11357 | 166.2 |
[M+NH4]+ | 289.15467 | 176.6 |
[M+K]+ | 310.08401 | 163.4 |
[M+H-H2O]+ | 254.11811 | 154.6 |
[M+HCOO]- | 316.11905 | 183.7 |
[M+CH3COO]- | 330.13470 | 195.9 |
[M+Na-2H]- | 292.09552 | 166.0 |
[M]+ | 271.12030 | 161.2 |
[M]- | 271.12140 | 161.2 |
Literature stripe
No literature data available for this compound.