CID 121581704
2-(2,3-dihydro-1,4-benzoxathiin-2-yl)ethan-1-amine hydrochloride
Structural Information
- Molecular Formula
- C10H13NOS
- SMILES
- C1C(OC2=CC=CC=C2S1)CCN
- InChI
- InChI=1S/C10H13NOS/c11-6-5-8-7-13-10-4-2-1-3-9(10)12-8/h1-4,8H,5-7,11H2
- InChIKey
- XDFWENMLDSZLDN-UHFFFAOYSA-N
- Compound name
- 2-(2,3-dihydro-1,4-benzoxathiin-2-yl)ethanamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 196.07908 | 138.0 |
[M+Na]+ | 218.06102 | 144.9 |
[M-H]- | 194.06452 | 142.4 |
[M+NH4]+ | 213.10562 | 157.3 |
[M+K]+ | 234.03496 | 142.6 |
[M+H-H2O]+ | 178.06906 | 132.2 |
[M+HCOO]- | 240.07000 | 154.0 |
[M+CH3COO]- | 254.08565 | 150.6 |
[M+Na-2H]- | 216.04647 | 143.8 |
[M]+ | 195.07125 | 137.2 |
[M]- | 195.07235 | 137.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.