CID 13428500

97699-32-6

Structural Information

Molecular Formula
C11H14N2OS
SMILES
CCN1CC(SC2=CC=CC=C21)C(=O)N
InChI
InChI=1S/C11H14N2OS/c1-2-13-7-10(11(12)14)15-9-6-4-3-5-8(9)13/h3-6,10H,2,7H2,1H3,(H2,12,14)
InChIKey
FQZRZMXJDJKTHV-UHFFFAOYSA-N
Compound name
4-ethyl-2,3-dihydro-1,4-benzothiazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.08269 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.089966 146.5
[M+Na]+ 245.071908 153.6
[M-H]- 221.075414 148.9
[M+NH4]+ 240.116513 164.7
[M+K]+ 261.045848 149.8
[M+H-H2O]+ 205.079950 140.0
[M+HCOO]- 267.080891 160.7
[M+CH3COO]- 281.096541 190.4
[M+Na-2H]- 243.057356 149.1
[M]+ 222.08214142 145.2
[M]- 222.08323858 145.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.