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]+ 231.185576 160.4
[M+Na]+ 253.167518 168.8
[M-H]- 229.171024 160.8
[M+NH4]+ 248.212123 173.4
[M+K]+ 269.141458 160.8
[M+H-H2O]+ 213.175560 145.3
[M+HCOO]- 275.176501 166.3
[M+CH3COO]- 289.192151 219.1
[M+Na-2H]- 251.152966 159.9
[M]+ 230.17775142 150.5
[M]- 230.17884858 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.