CID 82344

3-hydroxy-n,n-bis(2-hydroxyethyl)-2-naphthamide

Structural Information

Molecular Formula
C15H17NO4
SMILES
C1=CC=C2C=C(C(=CC2=C1)C(=O)N(CCO)CCO)O
InChI
InChI=1S/C15H17NO4/c17-7-5-16(6-8-18)15(20)13-9-11-3-1-2-4-12(11)10-14(13)19/h1-4,9-10,17-19H,5-8H2
InChIKey
AWOGQGYSUKXISO-UHFFFAOYSA-N
Compound name
3-hydroxy-N,N-bis(2-hydroxyethyl)naphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

21
Patents

275.11575 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.12303 161.4
[M+Na]+ 298.10497 167.1
[M-H]- 274.10847 163.1
[M+NH4]+ 293.14957 176.9
[M+K]+ 314.07891 164.2
[M+H-H2O]+ 258.11301 154.7
[M+HCOO]- 320.11395 180.8
[M+CH3COO]- 334.12960 197.8
[M+Na-2H]- 296.09042 165.4
[M]+ 275.11520 162.3
[M]- 275.11630 162.3
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