CID 7131905

2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethan-1-amine dihydrochloride

Structural Information

Molecular Formula
C10H12N2S2
SMILES
CC1=NC(=CS1)C2=CC=C(S2)CCN
InChI
InChI=1S/C10H12N2S2/c1-7-12-9(6-13-7)10-3-2-8(14-10)4-5-11/h2-3,6H,4-5,11H2,1H3
InChIKey
JNFOQNCFXSGQAK-UHFFFAOYSA-N
Compound name
2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

0
Patents

224.04419 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.05147 146.7
[M+Na]+ 247.03341 158.0
[M+NH4]+ 242.07801 156.4
[M+K]+ 263.00735 150.9
[M-H]- 223.03691 151.0
[M+Na-2H]- 245.01886 152.7
[M]+ 224.04364 150.5
[M]- 224.04474 150.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.