CID 28575187

3,4-dimethoxy-n-(2-methoxyethyl)aniline

Structural Information

Molecular Formula
C11H17NO3
SMILES
COCCNC1=CC(=C(C=C1)OC)OC
InChI
InChI=1S/C11H17NO3/c1-13-7-6-12-9-4-5-10(14-2)11(8-9)15-3/h4-5,8,12H,6-7H2,1-3H3
InChIKey
ZRLXNTVJZCELFT-UHFFFAOYSA-N
Compound name
3,4-dimethoxy-N-(2-methoxyethyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.12085 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.128126 145.7
[M+Na]+ 234.110068 153.1
[M-H]- 210.113574 149.5
[M+NH4]+ 229.154673 164.7
[M+K]+ 250.084008 152.3
[M+H-H2O]+ 194.118110 139.2
[M+HCOO]- 256.119051 171.3
[M+CH3COO]- 270.134701 190.6
[M+Na-2H]- 232.095516 151.8
[M]+ 211.12030142 150.7
[M]- 211.12139858 150.7
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.