CID 3067677

81816-88-8

Structural Information

Molecular Formula
C19H21NO3
SMILES
CCN(C1=CC=C(C=C1)OC)C(=O)C2CCC3=CC=CC=C3O2
InChI
InChI=1S/C19H21NO3/c1-3-20(15-9-11-16(22-2)12-10-15)19(21)18-13-8-14-6-4-5-7-17(14)23-18/h4-7,9-12,18H,3,8,13H2,1-2H3
InChIKey
ZCIJZMBDXBYMAR-UHFFFAOYSA-N
Compound name
N-ethyl-N-(4-methoxyphenyl)-3,4-dihydro-2H-chromene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.15213 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.15941 173.2
[M+Na]+ 334.14135 186.6
[M+NH4]+ 329.18595 181.7
[M+K]+ 350.11529 179.4
[M-H]- 310.14485 180.0
[M+Na-2H]- 332.12680 180.5
[M]+ 311.15158 177.1
[M]- 311.15268 177.1
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.