CID 6476688

N'-[(z)-4-(ethylamino)but-2-enyl]-n-[(z)-non-2-enyl]butane-1,4-diamine

Structural Information

Molecular Formula
C19H39N3
SMILES
CCCCCC/C=C\CNCCCCNC/C=C\CNCC
InChI
InChI=1S/C19H39N3/c1-3-5-6-7-8-9-10-16-21-18-13-14-19-22-17-12-11-15-20-4-2/h9-12,20-22H,3-8,13-19H2,1-2H3/b10-9-,12-11-
InChIKey
ZXLMWQFFCLWPKU-BASFJDSNSA-N
Compound name
N'-[(Z)-4-(ethylamino)but-2-enyl]-N-[(Z)-non-2-enyl]butane-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

309.3144 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.32168 183.9
[M+Na]+ 332.30362 183.8
[M-H]- 308.30712 181.6
[M+NH4]+ 327.34822 197.9
[M+K]+ 348.27756 179.0
[M+H-H2O]+ 292.31166 175.7
[M+HCOO]- 354.31260 206.8
[M+CH3COO]- 368.32825 218.2
[M+Na-2H]- 330.28907 185.0
[M]+ 309.31385 186.1
[M]- 309.31495 186.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.