CID 213944
27354-66-1
Structural Information
- Molecular Formula
- C12H14N2OS
- SMILES
- C1CC2=C(C(=CC=C2)NC3=NCCO3)SC1
- InChI
- InChI=1S/C12H14N2OS/c1-3-9-4-2-8-16-11(9)10(5-1)14-12-13-6-7-15-12/h1,3,5H,2,4,6-8H2,(H,13,14)
- InChIKey
- BZXAUWCYYQIOBP-UHFFFAOYSA-N
- Compound name
- N-(3,4-dihydro-2H-thiochromen-8-yl)-4,5-dihydro-1,3-oxazol-2-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 235.08997 | 148.9 |
[M+Na]+ | 257.07191 | 160.9 |
[M+NH4]+ | 252.11651 | 159.1 |
[M+K]+ | 273.04585 | 153.6 |
[M-H]- | 233.07541 | 155.2 |
[M+Na-2H]- | 255.05736 | 155.5 |
[M]+ | 234.08214 | 152.9 |
[M]- | 234.08324 | 152.9 |
Literature stripe
No literature data available for this compound.