CID 24836849
N,n-dimethyl-3,4-methylenedioxythiocinnamamide
Structural Information
- Molecular Formula
- C12H13NO2S
- SMILES
- CN(C)C(=S)/C=C/C1=CC2=C(C=C1)OCO2
- InChI
- InChI=1S/C12H13NO2S/c1-13(2)12(16)6-4-9-3-5-10-11(7-9)15-8-14-10/h3-7H,8H2,1-2H3/b6-4+
- InChIKey
- LHHXEAFYCVPMNW-GQCTYLIASA-N
- Compound name
- (E)-3-(1,3-benzodioxol-5-yl)-N,N-dimethylprop-2-enethioamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 236.07398 | 153.4 |
[M+Na]+ | 258.05592 | 161.1 |
[M-H]- | 234.05942 | 160.7 |
[M+NH4]+ | 253.10052 | 172.6 |
[M+K]+ | 274.02986 | 160.8 |
[M+H-H2O]+ | 218.06396 | 148.1 |
[M+HCOO]- | 280.06490 | 170.7 |
[M+CH3COO]- | 294.08055 | 193.3 |
[M+Na-2H]- | 256.04137 | 156.3 |
[M]+ | 235.06615 | 157.6 |
[M]- | 235.06725 | 157.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.