CID 97605

2-thiazoline, 2-(1-naphthylamino)-

Structural Information

Molecular Formula
C13H12N2S
SMILES
C1CSC(=N1)NC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C13H12N2S/c1-2-6-11-10(4-1)5-3-7-12(11)15-13-14-8-9-16-13/h1-7H,8-9H2,(H,14,15)
InChIKey
OPHJVMLHMZPRDG-UHFFFAOYSA-N
Compound name
N-naphthalen-1-yl-4,5-dihydro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

228.07211 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.079386 146.6
[M+Na]+ 251.061328 155.3
[M-H]- 227.064834 153.2
[M+NH4]+ 246.105933 166.7
[M+K]+ 267.035268 150.3
[M+H-H2O]+ 211.069370 139.7
[M+HCOO]- 273.070311 165.7
[M+CH3COO]- 287.085961 159.6
[M+Na-2H]- 249.046776 151.8
[M]+ 228.07156142 146.4
[M]- 228.07265858 146.4
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.