CID 10758250

301538-58-9

Structural Information

Molecular Formula
C19H17NO4
SMILES
CCOC(=O)N(C)C1=C(OC2=CC=CC=C21)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C19H17NO4/c1-3-23-19(22)20(2)16-14-11-7-8-12-15(14)24-18(16)17(21)13-9-5-4-6-10-13/h4-12H,3H2,1-2H3
InChIKey
MDPUNBKFWSNHLA-UHFFFAOYSA-N
Compound name
ethyl N-(2-benzoyl-1-benzofuran-3-yl)-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.11575 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.123026 175.5
[M+Na]+ 346.104968 183.1
[M-H]- 322.108474 185.8
[M+NH4]+ 341.149573 191.2
[M+K]+ 362.078908 182.0
[M+H-H2O]+ 306.113010 167.6
[M+HCOO]- 368.113951 199.9
[M+CH3COO]- 382.129601 212.0
[M+Na-2H]- 344.090416 179.0
[M]+ 323.11520142 182.1
[M]- 323.11629858 182.1
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.