CID 3057768
Isoquinoline, 1,2,3,4-tetrahydro-8-(3-methoxyphenyl)-, hydrochloride
Structural Information
- Molecular Formula
- C16H17NO
- SMILES
- COC1=CC=CC(=C1)C2=CC=CC3=C2CNCC3
- InChI
- InChI=1S/C16H17NO/c1-18-14-6-2-5-13(10-14)15-7-3-4-12-8-9-17-11-16(12)15/h2-7,10,17H,8-9,11H2,1H3
- InChIKey
- JKQKLAHGCJSHAM-UHFFFAOYSA-N
- Compound name
- 8-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 240.13829 | 154.5 |
[M+Na]+ | 262.12023 | 161.0 |
[M-H]- | 238.12373 | 158.8 |
[M+NH4]+ | 257.16483 | 170.8 |
[M+K]+ | 278.09417 | 155.7 |
[M+H-H2O]+ | 222.12827 | 146.1 |
[M+HCOO]- | 284.12921 | 172.5 |
[M+CH3COO]- | 298.14486 | 165.6 |
[M+Na-2H]- | 260.10568 | 160.8 |
[M]+ | 239.13046 | 150.9 |
[M]- | 239.13156 | 150.9 |
Literature stripe
No literature data available for this compound.