CID 218481

Brn 1690657

Structural Information

Molecular Formula
C16H21NO6
SMILES
CC1=C(OC2=C1C=CC(=C2OC)OC)C(=O)N(CCO)CCO
InChI
InChI=1S/C16H21NO6/c1-10-11-4-5-12(21-2)15(22-3)14(11)23-13(10)16(20)17(6-8-18)7-9-19/h4-5,18-19H,6-9H2,1-3H3
InChIKey
YJZRIQMZIKCENC-UHFFFAOYSA-N
Compound name
N,N-bis(2-hydroxyethyl)-6,7-dimethoxy-3-methyl-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.1369 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.144176 173.4
[M+Na]+ 346.126118 181.4
[M-H]- 322.129624 178.1
[M+NH4]+ 341.170723 188.7
[M+K]+ 362.100058 181.2
[M+H-H2O]+ 306.134160 167.0
[M+HCOO]- 368.135101 195.5
[M+CH3COO]- 382.150751 209.8
[M+Na-2H]- 344.111566 175.6
[M]+ 323.13635142 182.9
[M]- 323.13744858 182.9
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.