CID 165668320

N,n-dimethyl-2-[(2-methylpropyl)amino]-4-(methylsulfanyl)butanamide hydrochloride

Structural Information

Molecular Formula
C11H24N2OS
SMILES
CC(C)CNC(CCSC)C(=O)N(C)C
InChI
InChI=1S/C11H24N2OS/c1-9(2)8-12-10(6-7-15-5)11(14)13(3)4/h9-10,12H,6-8H2,1-5H3
InChIKey
RHXDGHZMSSRXBK-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(2-methylpropylamino)-4-methylsulfanylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.16093 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.16821 159.0
[M+Na]+ 255.15015 161.9
[M-H]- 231.15365 159.9
[M+NH4]+ 250.19475 177.3
[M+K]+ 271.12409 161.7
[M+H-H2O]+ 215.15819 152.1
[M+HCOO]- 277.15913 175.2
[M+CH3COO]- 291.17478 202.2
[M+Na-2H]- 253.13560 156.4
[M]+ 232.16038 162.4
[M]- 232.16148 162.4
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.