CID 3019974

84604-37-5

Structural Information

Molecular Formula
C16H18N2O3
SMILES
C1COCCN1C(=O)CNC2=CC=CC3=C2C=C(C=C3)O
InChI
InChI=1S/C16H18N2O3/c19-13-5-4-12-2-1-3-15(14(12)10-13)17-11-16(20)18-6-8-21-9-7-18/h1-5,10,17,19H,6-9,11H2
InChIKey
SALMMXBIIDVDTN-UHFFFAOYSA-N
Compound name
2-[(7-hydroxynaphthalen-1-yl)amino]-1-morpholin-4-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.13174 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.139016 165.0
[M+Na]+ 309.120958 169.5
[M-H]- 285.124464 169.5
[M+NH4]+ 304.165563 177.4
[M+K]+ 325.094898 166.6
[M+H-H2O]+ 269.129000 156.0
[M+HCOO]- 331.129941 181.2
[M+CH3COO]- 345.145591 200.0
[M+Na-2H]- 307.106406 170.4
[M]+ 286.13119142 161.4
[M]- 286.13228858 161.4
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.