CID 33202

Brn 2372959

Structural Information

Molecular Formula
C15H26N2O
SMILES
CCN(CC)CCOCCCC1=CC=C(C=C1)N
InChI
InChI=1S/C15H26N2O/c1-3-17(4-2)11-13-18-12-5-6-14-7-9-15(16)10-8-14/h7-10H,3-6,11-13,16H2,1-2H3
InChIKey
FGLMJCNWKCTXNU-UHFFFAOYSA-N
Compound name
4-[3-[2-(diethylamino)ethoxy]propyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.20451 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.21179 163.1
[M+Na]+ 273.19373 167.3
[M-H]- 249.19723 166.7
[M+NH4]+ 268.23833 180.3
[M+K]+ 289.16767 165.3
[M+H-H2O]+ 233.20177 155.3
[M+HCOO]- 295.20271 187.8
[M+CH3COO]- 309.21836 205.2
[M+Na-2H]- 271.17918 166.1
[M]+ 250.20396 165.7
[M]- 250.20506 165.7
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.