CID 22167701

4-(2-(dimethylamino)ethoxy)benzene-1,2-diamine

Structural Information

Molecular Formula
C10H17N3O
SMILES
CN(C)CCOC1=CC(=C(C=C1)N)N
InChI
InChI=1S/C10H17N3O/c1-13(2)5-6-14-8-3-4-9(11)10(12)7-8/h3-4,7H,5-6,11-12H2,1-2H3
InChIKey
FOQMUVRIBLMRNQ-UHFFFAOYSA-N
Compound name
4-[2-(dimethylamino)ethoxy]benzene-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

195.13716 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.144436 144.1
[M+Na]+ 218.126378 150.5
[M-H]- 194.129884 148.4
[M+NH4]+ 213.170983 163.2
[M+K]+ 234.100318 149.5
[M+H-H2O]+ 178.134420 137.1
[M+HCOO]- 240.135361 170.8
[M+CH3COO]- 254.151011 195.8
[M+Na-2H]- 216.111826 148.2
[M]+ 195.13661142 143.5
[M]- 195.13770858 143.5
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