CID 700289

4h,5h-naphtho[1,2-d][1,3]thiazol-2-amine

Structural Information

Molecular Formula
C11H10N2S
SMILES
C1CC2=C(C3=CC=CC=C31)N=C(S2)N
InChI
InChI=1S/C11H10N2S/c12-11-13-10-8-4-2-1-3-7(8)5-6-9(10)14-11/h1-4H,5-6H2,(H2,12,13)
InChIKey
RKFXIXZWTWCVBR-UHFFFAOYSA-N
Compound name
4,5-dihydrobenzo[e][1,3]benzothiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

33
Patents

202.05647 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.06375 138.6
[M+Na]+ 225.04569 148.9
[M-H]- 201.04919 142.8
[M+NH4]+ 220.09029 161.0
[M+K]+ 241.01963 144.1
[M+H-H2O]+ 185.05373 133.0
[M+HCOO]- 247.05467 156.0
[M+CH3COO]- 261.07032 152.2
[M+Na-2H]- 223.03114 143.9
[M]+ 202.05592 138.7
[M]- 202.05702 138.7
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

patents stripe