CID 71756728

N,n-dimethyl-4-(methylsulfanyl)pyrrolidin-3-amine dihydrochloride

Structural Information

Molecular Formula
C7H16N2S
SMILES
CN(C)C1CNCC1SC
InChI
InChI=1S/C7H16N2S/c1-9(2)6-4-8-5-7(6)10-3/h6-8H,4-5H2,1-3H3
InChIKey
GZXRMSQJHZBCEH-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-methylsulfanylpyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

160.10342 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.11070 136.0
[M+Na]+ 183.09264 144.3
[M+NH4]+ 178.13724 144.9
[M+K]+ 199.06658 138.9
[M-H]- 159.09614 137.5
[M+Na-2H]- 181.07809 139.2
[M]+ 160.10287 137.8
[M]- 160.10397 137.8
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.