CID 3055303
72278-57-0
Structural Information
- Molecular Formula
- C18H23NO3S
- SMILES
- CC(CN1CCS(=O)(=O)CC1)C2=CC3=C(C=C2)C=C(C=C3)OC
- InChI
- InChI=1S/C18H23NO3S/c1-14(13-19-7-9-23(20,21)10-8-19)15-3-4-17-12-18(22-2)6-5-16(17)11-15/h3-6,11-12,14H,7-10,13H2,1-2H3
- InChIKey
- NJHZOYZJTWGSRU-UHFFFAOYSA-N
- Compound name
- 4-[2-(6-methoxynaphthalen-2-yl)propyl]-1,4-thiazinane 1,1-dioxide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 334.14714 | 175.6 |
[M+Na]+ | 356.12908 | 182.4 |
[M-H]- | 332.13258 | 181.1 |
[M+NH4]+ | 351.17368 | 191.3 |
[M+K]+ | 372.10302 | 178.2 |
[M+H-H2O]+ | 316.13712 | 167.5 |
[M+HCOO]- | 378.13806 | 187.7 |
[M+CH3COO]- | 392.15371 | 207.5 |
[M+Na-2H]- | 354.11453 | 177.6 |
[M]+ | 333.13931 | 177.2 |
[M]- | 333.14041 | 177.2 |
Literature stripe
No literature data available for this compound.