CID 104613

2-[2-(1-naphthylamino)ethoxy]ethanol

Structural Information

Molecular Formula
C14H17NO2
SMILES
C1=CC=C2C(=C1)C=CC=C2NCCOCCO
InChI
InChI=1S/C14H17NO2/c16-9-11-17-10-8-15-14-7-3-5-12-4-1-2-6-13(12)14/h1-7,15-16H,8-11H2
InChIKey
LKDJOSCYSCYSJE-UHFFFAOYSA-N
Compound name
2-[2-(naphthalen-1-ylamino)ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

231.12593 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.13321 150.6
[M+Na]+ 254.11515 156.8
[M-H]- 230.11865 153.3
[M+NH4]+ 249.15975 168.6
[M+K]+ 270.08909 153.0
[M+H-H2O]+ 214.12319 143.8
[M+HCOO]- 276.12413 173.4
[M+CH3COO]- 290.13978 191.3
[M+Na-2H]- 252.10060 158.7
[M]+ 231.12538 151.7
[M]- 231.12648 151.7
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

patents stripe