CID 114584

1,2-ethanediamine, n-(1,3-dimethylbutylidene)-n'-[2-[(1,3-dimethylbutylidene)amino]ethyl]-

Structural Information

Molecular Formula
C16H33N3
SMILES
CC(C)CC(=NCCNCCN=C(C)CC(C)C)C
InChI
InChI=1S/C16H33N3/c1-13(2)11-15(5)18-9-7-17-8-10-19-16(6)12-14(3)4/h13-14,17H,7-12H2,1-6H3
InChIKey
CJAGRJAFLCPABV-UHFFFAOYSA-N
Compound name
2-(4-methylpentan-2-ylideneamino)-N-[2-(4-methylpentan-2-ylideneamino)ethyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

274
Patents

267.26746 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.27474 176.3
[M+Na]+ 290.25668 177.4
[M-H]- 266.26018 177.8
[M+NH4]+ 285.30128 193.2
[M+K]+ 306.23062 177.1
[M+H-H2O]+ 250.26472 168.6
[M+HCOO]- 312.26566 199.1
[M+CH3COO]- 326.28131 217.6
[M+Na-2H]- 288.24213 174.5
[M]+ 267.26691 178.5
[M]- 267.26801 178.5
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

patents stripe