CID 414461

13107-10-3

Structural Information

Molecular Formula
C12H20N
SMILES
C=CC[N+](CC=C)(CC=C)CC=C
InChI
InChI=1S/C12H20N/c1-5-9-13(10-6-2,11-7-3)12-8-4/h5-8H,1-4,9-12H2/q+1
InChIKey
SAJMIAZRBZSBQM-UHFFFAOYSA-N
Compound name
tetrakis(prop-2-enyl)azanium
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

12483
Patents

178.15958 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.166856 140.6
[M+Na]+ 201.148798 146.7
[M-H]- 177.152304 142.0
[M+NH4]+ 196.193403 161.3
[M+K]+ 217.122738 138.2
[M+H-H2O]+ 161.156840 138.7
[M+HCOO]- 223.157781 163.9
[M+CH3COO]- 237.173431 182.6
[M+Na-2H]- 199.134246 148.5
[M]+ 178.15903142 140.4
[M]- 178.16012858 140.4
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