CID 88252

19795-11-0

Structural Information

Molecular Formula
C16H20N2O2
SMILES
CN(C)CCCNC(=O)C1=CC2=CC=CC=C2C=C1O
InChI
InChI=1S/C16H20N2O2/c1-18(2)9-5-8-17-16(20)14-10-12-6-3-4-7-13(12)11-15(14)19/h3-4,6-7,10-11,19H,5,8-9H2,1-2H3,(H,17,20)
InChIKey
DFTPLSXMJPFUMX-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-3-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

272.15247 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.159746 163.6
[M+Na]+ 295.141688 169.2
[M-H]- 271.145194 167.8
[M+NH4]+ 290.186293 180.4
[M+K]+ 311.115628 166.4
[M+H-H2O]+ 255.149730 156.2
[M+HCOO]- 317.150671 186.4
[M+CH3COO]- 331.166321 206.4
[M+Na-2H]- 293.127136 168.3
[M]+ 272.15192142 164.9
[M]- 272.15301858 164.9
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