CID 54593686

(2-aminoethyl)[(2,4-dimethoxyphenyl)methyl]amine dihydrochloride

Structural Information

Molecular Formula
C11H18N2O2
SMILES
COC1=CC(=C(C=C1)CNCCN)OC
InChI
InChI=1S/C11H18N2O2/c1-14-10-4-3-9(8-13-6-5-12)11(7-10)15-2/h3-4,7,13H,5-6,8,12H2,1-2H3
InChIKey
HLZCZXQCKGZBRW-UHFFFAOYSA-N
Compound name
N'-[(2,4-dimethoxyphenyl)methyl]ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.13683 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.14411 147.4
[M+Na]+ 233.12605 157.9
[M+NH4]+ 228.17065 154.9
[M+K]+ 249.09999 151.8
[M-H]- 209.12955 150.1
[M+Na-2H]- 231.11150 153.1
[M]+ 210.13628 149.4
[M]- 210.13738 149.4
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.