CID 61331850

4-(4-methyl-1,3-thiazol-2-yl)oxan-4-amine

Structural Information

Molecular Formula
C9H14N2OS
SMILES
CC1=CSC(=N1)C2(CCOCC2)N
InChI
InChI=1S/C9H14N2OS/c1-7-6-13-8(11-7)9(10)2-4-12-5-3-9/h6H,2-5,10H2,1H3
InChIKey
VFKQEUXAKPHFRE-UHFFFAOYSA-N
Compound name
4-(4-methyl-1,3-thiazol-2-yl)oxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.08269 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.089966 140.5
[M+Na]+ 221.071908 147.9
[M-H]- 197.075414 146.1
[M+NH4]+ 216.116513 161.0
[M+K]+ 237.045848 146.4
[M+H-H2O]+ 181.079950 134.6
[M+HCOO]- 243.080891 156.6
[M+CH3COO]- 257.096541 153.3
[M+Na-2H]- 219.057356 143.6
[M]+ 198.08214142 138.4
[M]- 198.08323858 138.4
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

No patent data available for this compound.