CID 206145

Brn 3006294

Structural Information

Molecular Formula
C19H24N2O4
SMILES
CCN(CC)CCNC(=O)COC1=C(C=CC2=CC=CC=C21)C(=O)O
InChI
InChI=1S/C19H24N2O4/c1-3-21(4-2)12-11-20-17(22)13-25-18-15-8-6-5-7-14(15)9-10-16(18)19(23)24/h5-10H,3-4,11-13H2,1-2H3,(H,20,22)(H,23,24)
InChIKey
QGTPUWNUVNNMSP-UHFFFAOYSA-N
Compound name
1-[2-[2-(diethylamino)ethylamino]-2-oxoethoxy]naphthalene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.1736 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.18088 182.2
[M+Na]+ 367.16282 191.3
[M+NH4]+ 362.20742 187.7
[M+K]+ 383.13676 185.9
[M-H]- 343.16632 183.8
[M+Na-2H]- 365.14827 185.7
[M]+ 344.17305 183.5
[M]- 344.17415 183.5
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

No patent data available for this compound.