CID 58398128

Methyl({[(3s)-piperidin-3-yl]methyl})amine dihydrochloride

Structural Information

Molecular Formula
C7H16N2
SMILES
CNC[C@@H]1CCCNC1
InChI
InChI=1S/C7H16N2/c1-8-5-7-3-2-4-9-6-7/h7-9H,2-6H2,1H3/t7-/m0/s1
InChIKey
CYDMJLIOBYDVSP-ZETCQYMHSA-N
Compound name
N-methyl-1-[(3S)-piperidin-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

128.13135 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.138626 129.5
[M+Na]+ 151.120568 133.3
[M-H]- 127.124074 129.3
[M+NH4]+ 146.165173 149.0
[M+K]+ 167.094508 131.6
[M+H-H2O]+ 111.128610 123.1
[M+HCOO]- 173.129551 148.6
[M+CH3COO]- 187.145201 171.2
[M+Na-2H]- 149.106016 135.6
[M]+ 128.13080142 122.2
[M]- 128.13189858 122.2
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

patents stripe