CID 207982

31329-87-0

Structural Information

Molecular Formula
C10H14N2S
SMILES
CC1=NC(=CC=C1)CC(=S)N(C)C
InChI
InChI=1S/C10H14N2S/c1-8-5-4-6-9(11-8)7-10(13)12(2)3/h4-6H,7H2,1-3H3
InChIKey
LONOFDILBMBXAF-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(6-methylpyridin-2-yl)ethanethioamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.08777 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.09505 143.1
[M+Na]+ 217.07699 155.1
[M+NH4]+ 212.12159 152.0
[M+K]+ 233.05093 146.8
[M-H]- 193.08049 146.0
[M+Na-2H]- 215.06244 149.6
[M]+ 194.08722 146.1
[M]- 194.08832 146.1
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.