CID 9574488

Akos024328803

Structural Information

Molecular Formula
C17H16N2O3
SMILES
C\1COC2=CC=CC=C2/C1=N/NC(=O)COC3=CC=CC=C3
InChI
InChI=1S/C17H16N2O3/c20-17(12-22-13-6-2-1-3-7-13)19-18-15-10-11-21-16-9-5-4-8-14(15)16/h1-9H,10-12H2,(H,19,20)/b18-15+
InChIKey
PPOSPXPBPGEHDV-OBGWFSINSA-N
Compound name
N-[(E)-2,3-dihydrochromen-4-ylideneamino]-2-phenoxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

296.1161 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.123376 165.7
[M+Na]+ 319.105318 170.2
[M-H]- 295.108824 174.2
[M+NH4]+ 314.149923 179.8
[M+K]+ 335.079258 168.2
[M+H-H2O]+ 279.113360 156.4
[M+HCOO]- 341.114301 188.5
[M+CH3COO]- 355.129951 207.3
[M+Na-2H]- 317.090766 173.6
[M]+ 296.11555142 165.1
[M]- 296.11664858 165.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.