CID 56644
3,4-dihydro-7-methyl-2-(piperidinomethyl)-1(2h)-naphthalenone hydrochloride
Structural Information
- Molecular Formula
- C17H23NO
- SMILES
- CC1=CC2=C(CCC(C2=O)CN3CCCCC3)C=C1
- InChI
- InChI=1S/C17H23NO/c1-13-5-6-14-7-8-15(17(19)16(14)11-13)12-18-9-3-2-4-10-18/h5-6,11,15H,2-4,7-10,12H2,1H3
- InChIKey
- CCPDMZIFJGEXSQ-UHFFFAOYSA-N
- Compound name
- 7-methyl-2-(piperidin-1-ylmethyl)-3,4-dihydro-2H-naphthalen-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 258.18526 | 162.1 |
[M+Na]+ | 280.16720 | 166.6 |
[M-H]- | 256.17070 | 166.8 |
[M+NH4]+ | 275.21180 | 178.4 |
[M+K]+ | 296.14114 | 162.1 |
[M+H-H2O]+ | 240.17524 | 153.4 |
[M+HCOO]- | 302.17618 | 177.0 |
[M+CH3COO]- | 316.19183 | 172.1 |
[M+Na-2H]- | 278.15265 | 164.3 |
[M]+ | 257.17743 | 156.0 |
[M]- | 257.17853 | 156.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.