CID 3072001
3,5-dihydro-5-methyl-(1,2,4)triazino(3,4-c)(1,4)benzothiazin-2(1h)-one
Structural Information
- Molecular Formula
- C11H11N3OS
- SMILES
- CC1C2=NNC(=O)CN2C3=CC=CC=C3S1
- InChI
- InChI=1S/C11H11N3OS/c1-7-11-13-12-10(15)6-14(11)8-4-2-3-5-9(8)16-7/h2-5,7H,6H2,1H3,(H,12,15)
- InChIKey
- QSTDYUOTEGBUHI-UHFFFAOYSA-N
- Compound name
- 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 234.06957 | 148.3 |
[M+Na]+ | 256.05151 | 157.7 |
[M-H]- | 232.05501 | 148.1 |
[M+NH4]+ | 251.09611 | 164.4 |
[M+K]+ | 272.02545 | 152.1 |
[M+H-H2O]+ | 216.05955 | 140.9 |
[M+HCOO]- | 278.06049 | 157.6 |
[M+CH3COO]- | 292.07614 | 159.0 |
[M+Na-2H]- | 254.03696 | 153.6 |
[M]+ | 233.06174 | 146.4 |
[M]- | 233.06284 | 146.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.