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]+ 223.08997 146.5
[M+Na]+ 245.07191 153.6
[M-H]- 221.07541 148.9
[M+NH4]+ 240.11651 164.7
[M+K]+ 261.04585 149.8
[M+H-H2O]+ 205.07995 140.0
[M+HCOO]- 267.08089 160.7
[M+CH3COO]- 281.09654 190.4
[M+Na-2H]- 243.05736 149.1
[M]+ 222.08214 145.2
[M]- 222.08324 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.