CID 82707055

Methoxy[1-(2-methyl-1,3-thiazol-4-yl)ethyl]amine

Structural Information

Molecular Formula
C7H12N2OS
SMILES
CC1=NC(=CS1)C(C)NOC
InChI
InChI=1S/C7H12N2OS/c1-5(9-10-3)7-4-11-6(2)8-7/h4-5,9H,1-3H3
InChIKey
SJHQWTVXXDOONU-UHFFFAOYSA-N
Compound name
N-methoxy-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.06703 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.07431 135.5
[M+Na]+ 195.05625 143.8
[M-H]- 171.05975 138.4
[M+NH4]+ 190.10085 156.9
[M+K]+ 211.03019 142.5
[M+H-H2O]+ 155.06429 129.3
[M+HCOO]- 217.06523 155.0
[M+CH3COO]- 231.08088 180.6
[M+Na-2H]- 193.04170 137.4
[M]+ 172.06648 138.6
[M]- 172.06758 138.6
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.