CID 209208

2-p-dimethylaminophenyl-3-methyl-4-ethyl-2-thiazolinium perchlorate

Structural Information

Molecular Formula
C14H21N2S
SMILES
CCC1CSC(=[N+]1C)C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C14H21N2S/c1-5-12-10-17-14(16(12)4)11-6-8-13(9-7-11)15(2)3/h6-9,12H,5,10H2,1-4H3/q+1
InChIKey
HTKYEEIQYWMEHA-UHFFFAOYSA-N
Compound name
4-(4-ethyl-3-methyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.14255 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.14983 154.7
[M+Na]+ 272.13177 169.0
[M+NH4]+ 267.17637 165.4
[M+K]+ 288.10571 162.1
[M-H]- 248.13527 161.5
[M+Na-2H]- 270.11722 162.8
[M]+ 249.14200 159.6
[M]- 249.14310 159.6
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.