CID 62402846

Methyl[(4-methyl-2-propyl-1,3-thiazol-5-yl)methyl]amine

Structural Information

Molecular Formula
C9H16N2S
SMILES
CCCC1=NC(=C(S1)CNC)C
InChI
InChI=1S/C9H16N2S/c1-4-5-9-11-7(2)8(12-9)6-10-3/h10H,4-6H2,1-3H3
InChIKey
JYHFYPHSPOGSBL-UHFFFAOYSA-N
Compound name
N-methyl-1-(4-methyl-2-propyl-1,3-thiazol-5-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.10342 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.110696 139.9
[M+Na]+ 207.092638 148.8
[M-H]- 183.096144 142.8
[M+NH4]+ 202.137243 161.4
[M+K]+ 223.066578 146.0
[M+H-H2O]+ 167.100680 133.8
[M+HCOO]- 229.101621 159.6
[M+CH3COO]- 243.117271 185.0
[M+Na-2H]- 205.078086 141.3
[M]+ 184.10287142 143.4
[M]- 184.10396858 143.4
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.