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]+ 297.12338 165.7
[M+Na]+ 319.10532 170.2
[M-H]- 295.10882 174.2
[M+NH4]+ 314.14992 179.8
[M+K]+ 335.07926 168.2
[M+H-H2O]+ 279.11336 156.4
[M+HCOO]- 341.11430 188.5
[M+CH3COO]- 355.12995 207.3
[M+Na-2H]- 317.09077 173.6
[M]+ 296.11555 165.1
[M]- 296.11665 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.