CID 12498995

1415962-26-3

Structural Information

Molecular Formula
C15H30N3
SMILES
CCN(CC)C1=C(C1=[N+](CC)CC)N(CC)CC
InChI
InChI=1S/C15H30N3/c1-7-16(8-2)13-14(17(9-3)10-4)15(13)18(11-5)12-6/h7-12H2,1-6H3/q+1
InChIKey
XLFUIJHKQHIXCH-UHFFFAOYSA-N
Compound name
[2,3-bis(diethylamino)cycloprop-2-en-1-ylidene]-diethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.24397 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.25125 156.5
[M+Na]+ 275.23319 163.2
[M-H]- 251.23669 165.1
[M+NH4]+ 270.27779 170.6
[M+K]+ 291.20713 156.8
[M+H-H2O]+ 235.24123 151.7
[M+HCOO]- 297.24217 183.7
[M+CH3COO]- 311.25782 213.1
[M+Na-2H]- 273.21864 160.6
[M]+ 252.24342 163.5
[M]- 252.24452 163.5
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.