CID 61787874

1-[1-(prop-2-yn-1-yl)piperidin-4-yl]methanamine dihydrochloride

Structural Information

Molecular Formula
C9H16N2
SMILES
C#CCN1CCC(CC1)CN
InChI
InChI=1S/C9H16N2/c1-2-5-11-6-3-9(8-10)4-7-11/h1,9H,3-8,10H2
InChIKey
LBWLVERUVXCCHB-UHFFFAOYSA-N
Compound name
(1-prop-2-ynylpiperidin-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.13135 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.13863 133.2
[M+Na]+ 175.12057 140.4
[M-H]- 151.12407 132.8
[M+NH4]+ 170.16517 150.2
[M+K]+ 191.09451 137.0
[M+H-H2O]+ 135.12861 120.8
[M+HCOO]- 197.12955 147.2
[M+CH3COO]- 211.14520 187.1
[M+Na-2H]- 173.10602 136.5
[M]+ 152.13080 122.6
[M]- 152.13190 122.6
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.