CID 62941621

N-ethyl-4h-chromeno[4,3-d][1,3]thiazol-2-amine

Structural Information

Molecular Formula
C12H12N2OS
SMILES
CCNC1=NC2=C(S1)COC3=CC=CC=C32
InChI
InChI=1S/C12H12N2OS/c1-2-13-12-14-11-8-5-3-4-6-9(8)15-7-10(11)16-12/h3-6H,2,7H2,1H3,(H,13,14)
InChIKey
NSDBGOZCYRZJRI-UHFFFAOYSA-N
Compound name
N-ethyl-4H-chromeno[4,3-d][1,3]thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.06703 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.07431 147.7
[M+Na]+ 255.05625 160.9
[M+NH4]+ 250.10085 158.1
[M+K]+ 271.03019 153.3
[M-H]- 231.05975 152.8
[M+Na-2H]- 253.04170 153.1
[M]+ 232.06648 151.6
[M]- 232.06758 151.6
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.