CID 61287604

Methyl({1-[4-methyl-2-(propan-2-yl)-1,3-thiazol-5-yl]ethyl})amine

Structural Information

Molecular Formula
C10H18N2S
SMILES
CC1=C(SC(=N1)C(C)C)C(C)NC
InChI
InChI=1S/C10H18N2S/c1-6(2)10-12-8(4)9(13-10)7(3)11-5/h6-7,11H,1-5H3
InChIKey
CVDRFFDIOJTHQW-UHFFFAOYSA-N
Compound name
N-methyl-1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.11906 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.12634 145.5
[M+Na]+ 221.10828 153.2
[M-H]- 197.11178 148.4
[M+NH4]+ 216.15288 166.2
[M+K]+ 237.08222 151.2
[M+H-H2O]+ 181.11632 139.3
[M+HCOO]- 243.11726 162.7
[M+CH3COO]- 257.13291 189.7
[M+Na-2H]- 219.09373 144.1
[M]+ 198.11851 148.1
[M]- 198.11961 148.1
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.