CID 11046968
4-methyl-n-(phenyl-lambda3-iodaneylidene)benzenesulfonamide
Structural Information
- Molecular Formula
- C13H12INO2S
- SMILES
- CC1=CC=C(C=C1)S(=O)(=O)N=IC2=CC=CC=C2
- InChI
- InChI=1S/C13H12INO2S/c1-11-7-9-13(10-8-11)18(16,17)15-14-12-5-3-2-4-6-12/h2-10H,1H3
- InChIKey
- WECCHUKCGHQAQJ-UHFFFAOYSA-N
- Compound name
- 4-methyl-N-(phenyl-lambda3-iodanylidene)benzenesulfonamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 373.97063 | 170.1 |
[M+Na]+ | 395.95257 | 171.5 |
[M-H]- | 371.95607 | 170.8 |
[M+NH4]+ | 390.99717 | 182.3 |
[M+K]+ | 411.92651 | 172.9 |
[M+H-H2O]+ | 355.96061 | 158.7 |
[M+HCOO]- | 417.96155 | 186.0 |
[M+CH3COO]- | 431.97720 | 203.3 |
[M+Na-2H]- | 393.93802 | 163.6 |
[M]+ | 372.96280 | 169.6 |
[M]- | 372.96390 | 169.6 |