CID 45927

N-(gamma-dimethylaminopropyl)-2-methyl thiodiphenylamine hydrochloride

Structural Information

Molecular Formula
C18H24N2S
SMILES
CN(C)CCCN(C1=CC=CC=C1)C2=CC=CC=C2SC
InChI
InChI=1S/C18H24N2S/c1-19(2)14-9-15-20(16-10-5-4-6-11-16)17-12-7-8-13-18(17)21-3/h4-8,10-13H,9,14-15H2,1-3H3
InChIKey
IHIVQRLXSSUZAT-UHFFFAOYSA-N
Compound name
N,N-dimethyl-N'-(2-methylsulfanylphenyl)-N'-phenylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.16602 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.17330 171.6
[M+Na]+ 323.15524 184.4
[M+NH4]+ 318.19984 181.4
[M+K]+ 339.12918 173.7
[M-H]- 299.15874 178.9
[M+Na-2H]- 321.14069 181.4
[M]+ 300.16547 176.2
[M]- 300.16657 176.2
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.