CID 13127894

Bis(diethylamino)methylidene-dibutylazanium;chloride

Structural Information

Molecular Formula
C17H38N3
SMILES
CCCC[N+](=C(N(CC)CC)N(CC)CC)CCCC
InChI
InChI=1S/C17H38N3/c1-7-13-15-20(16-14-8-2)17(18(9-3)10-4)19(11-5)12-6/h7-16H2,1-6H3/q+1
InChIKey
NXAKLIIVEQIHTH-UHFFFAOYSA-N
Compound name
bis(diethylamino)methylidene-dibutylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

284.30658 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.31386 181.0
[M+Na]+ 307.29580 182.0
[M-H]- 283.29930 184.0
[M+NH4]+ 302.34040 197.9
[M+K]+ 323.26974 177.5
[M+H-H2O]+ 267.30384 175.7
[M+HCOO]- 329.30478 204.6
[M+CH3COO]- 343.32043 216.4
[M+Na-2H]- 305.28125 181.5
[M]+ 284.30603 184.8
[M]- 284.30713 184.8
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