CID 37297

Brn 1639583

Structural Information

Molecular Formula
C15H22N2
SMILES
C#CCN(CCN1CC2CCC(C2)C1)CC#C
InChI
InChI=1S/C15H22N2/c1-3-7-16(8-4-2)9-10-17-12-14-5-6-15(11-14)13-17/h1-2,14-15H,5-13H2
InChIKey
MJEPLEDFWADIFD-UHFFFAOYSA-N
Compound name
N-[2-(3-azabicyclo[3.2.1]octan-3-yl)ethyl]-N-prop-2-ynylprop-2-yn-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.1783 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.18558 160.4
[M+Na]+ 253.16752 168.8
[M-H]- 229.17102 160.8
[M+NH4]+ 248.21212 173.4
[M+K]+ 269.14146 160.8
[M+H-H2O]+ 213.17556 145.3
[M+HCOO]- 275.17650 166.3
[M+CH3COO]- 289.19215 219.1
[M+Na-2H]- 251.15297 159.9
[M]+ 230.17775 150.5
[M]- 230.17885 150.5
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.