CID 59286

1-naphthylamine, 5,6,7,8-tetrahydro-n-(5,6-dihydro-4h-1,3-thiazin-2-yl)-

Structural Information

Molecular Formula
C14H18N2S
SMILES
C1CCC2=C(C1)C=CC=C2NC3=NCCCS3
InChI
InChI=1S/C14H18N2S/c1-2-7-12-11(5-1)6-3-8-13(12)16-14-15-9-4-10-17-14/h3,6,8H,1-2,4-5,7,9-10H2,(H,15,16)
InChIKey
UOMFLZNHLUVGJL-UHFFFAOYSA-N
Compound name
N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

246.11906 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.12634 152.8
[M+Na]+ 269.10828 165.6
[M+NH4]+ 264.15288 163.6
[M+K]+ 285.08222 155.0
[M-H]- 245.11178 159.0
[M+Na-2H]- 267.09373 161.1
[M]+ 246.11851 156.9
[M]- 246.11961 156.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.