CID 43174403

3-(2-(2-methoxyethoxy)ethoxy)aniline

Structural Information

Molecular Formula
C11H17NO3
SMILES
COCCOCCOC1=CC=CC(=C1)N
InChI
InChI=1S/C11H17NO3/c1-13-5-6-14-7-8-15-11-4-2-3-10(12)9-11/h2-4,9H,5-8,12H2,1H3
InChIKey
DEOFYPCJGRLJKB-UHFFFAOYSA-N
Compound name
3-[2-(2-methoxyethoxy)ethoxy]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

211.12085 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 146.4
[M+Na]+ 234.11007 152.8
[M-H]- 210.11357 149.3
[M+NH4]+ 229.15467 164.7
[M+K]+ 250.08401 151.6
[M+H-H2O]+ 194.11811 139.6
[M+HCOO]- 256.11905 171.4
[M+CH3COO]- 270.13470 188.8
[M+Na-2H]- 232.09552 152.1
[M]+ 211.12030 150.0
[M]- 211.12140 150.0
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

patents stripe