CID 6450915

1,6,11-triisopropyl-di-2-butenylenetriamine

Structural Information

Molecular Formula
C17H35N3
SMILES
CC(NC/C=C/CN(C(C)C)C/C=C/CNC(C)C)C
InChI
InChI=1S/C17H35N3/c1-15(2)18-11-7-9-13-20(17(5)6)14-10-8-12-19-16(3)4/h7-10,15-19H,11-14H2,1-6H3/b9-7+,10-8+
InChIKey
NQNPALSZCSPJTA-FIFLTTCUSA-N
Compound name
(E)-N,N'-di(propan-2-yl)-N'-[(E)-4-(propan-2-ylamino)but-2-enyl]but-2-ene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

281.2831 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.29038 181.0
[M+Na]+ 304.27232 181.3
[M-H]- 280.27582 180.9
[M+NH4]+ 299.31692 196.6
[M+K]+ 320.24626 179.9
[M+H-H2O]+ 264.28036 173.3
[M+HCOO]- 326.28130 202.0
[M+CH3COO]- 340.29695 218.0
[M+Na-2H]- 302.25777 178.1
[M]+ 281.28255 181.7
[M]- 281.28365 181.7
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.