CID 45546
N-methyl-6-ethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride
Structural Information
- Molecular Formula
- C12H17NO
- SMILES
- CCOC1=CC2=C(CN(CC2)C)C=C1
- InChI
- InChI=1S/C12H17NO/c1-3-14-12-5-4-11-9-13(2)7-6-10(11)8-12/h4-5,8H,3,6-7,9H2,1-2H3
- InChIKey
- ZORGQKPNLBAWGR-UHFFFAOYSA-N
- Compound name
- 6-ethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 192.13829 | 142.4 |
[M+Na]+ | 214.12023 | 149.8 |
[M-H]- | 190.12373 | 145.2 |
[M+NH4]+ | 209.16483 | 162.1 |
[M+K]+ | 230.09417 | 147.2 |
[M+H-H2O]+ | 174.12827 | 135.5 |
[M+HCOO]- | 236.12921 | 161.9 |
[M+CH3COO]- | 250.14486 | 185.4 |
[M+Na-2H]- | 212.10568 | 148.9 |
[M]+ | 191.13046 | 142.0 |
[M]- | 191.13156 | 142.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.