CID 12448555

66571-60-6

Structural Information

Molecular Formula
C5H7BrN2S
SMILES
CN(C)C1=NC=C(S1)Br
InChI
InChI=1S/C5H7BrN2S/c1-8(2)5-7-3-4(6)9-5/h3H,1-2H3
InChIKey
FBKKLSJTAVXQBV-UHFFFAOYSA-N
Compound name
5-bromo-N,N-dimethyl-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

205.95132 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.95860 127.0
[M+Na]+ 228.94054 140.6
[M-H]- 204.94404 134.5
[M+NH4]+ 223.98514 151.6
[M+K]+ 244.91448 130.8
[M+H-H2O]+ 188.94858 126.9
[M+HCOO]- 250.94952 146.5
[M+CH3COO]- 264.96517 185.7
[M+Na-2H]- 226.92599 132.5
[M]+ 205.95077 148.4
[M]- 205.95187 148.4
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

patents stripe