CID 33204

Brn 2371878

Structural Information

Molecular Formula
C16H28N2O
SMILES
CC(C)N(CCOCCC1=CC=C(C=C1)N)C(C)C
InChI
InChI=1S/C16H28N2O/c1-13(2)18(14(3)4)10-12-19-11-9-15-5-7-16(17)8-6-15/h5-8,13-14H,9-12,17H2,1-4H3
InChIKey
ARERBHYOFGDIPC-UHFFFAOYSA-N
Compound name
4-[2-[2-[di(propan-2-yl)amino]ethoxy]ethyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.22015 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.22743 169.2
[M+Na]+ 287.20937 172.4
[M-H]- 263.21287 172.7
[M+NH4]+ 282.25397 185.6
[M+K]+ 303.18331 171.3
[M+H-H2O]+ 247.21741 161.4
[M+HCOO]- 309.21835 191.5
[M+CH3COO]- 323.23400 209.9
[M+Na-2H]- 285.19482 169.0
[M]+ 264.21960 170.9
[M]- 264.22070 170.9
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