CID 1973486
(5z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Structural Information
- Molecular Formula
- C18H13NO4S2
- SMILES
- COC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/SC2=S
- InChI
- InChI=1S/C18H13NO4S2/c1-21-13-5-3-12(4-6-13)19-17(20)16(25-18(19)24)9-11-2-7-14-15(8-11)23-10-22-14/h2-9H,10H2,1H3/b16-9-
- InChIKey
- JMXLIACXRVAMGP-SXGWCWSVSA-N
- Compound name
- (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 372.03588 | 184.3 |
[M+Na]+ | 394.01782 | 195.4 |
[M-H]- | 370.02132 | 196.0 |
[M+NH4]+ | 389.06242 | 198.8 |
[M+K]+ | 409.99176 | 191.8 |
[M+H-H2O]+ | 354.02586 | 180.3 |
[M+HCOO]- | 416.02680 | 195.2 |
[M+CH3COO]- | 430.04245 | 196.0 |
[M+Na-2H]- | 392.00327 | 181.5 |
[M]+ | 371.02805 | 189.7 |
[M]- | 371.02915 | 189.7 |
Literature stripe
No literature data available for this compound.