CID 15017643

2089258-70-6

Structural Information

Molecular Formula
C8H13N3S
SMILES
CN(C)C1=NC2=C(S1)CNCC2
InChI
InChI=1S/C8H13N3S/c1-11(2)8-10-6-3-4-9-5-7(6)12-8/h9H,3-5H2,1-2H3
InChIKey
IJZOLPKKYVQWTF-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

183.08302 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.090296 137.4
[M+Na]+ 206.072238 145.0
[M-H]- 182.075744 139.2
[M+NH4]+ 201.116843 158.0
[M+K]+ 222.046178 142.8
[M+H-H2O]+ 166.080280 130.8
[M+HCOO]- 228.081221 152.4
[M+CH3COO]- 242.096871 149.8
[M+Na-2H]- 204.057686 140.3
[M]+ 183.08247142 136.3
[M]- 183.08356858 136.3
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