CID 9588887

N-(2-(dimethylamino)ethoxy)-2,3-dihydro-1,4-benzodioxin-2-carboximidamide monohydrochloride

Structural Information

Molecular Formula
C13H19N3O3
SMILES
CN(C)CCO/N=C(/C1COC2=CC=CC=C2O1)\N
InChI
InChI=1S/C13H19N3O3/c1-16(2)7-8-18-15-13(14)12-9-17-10-5-3-4-6-11(10)19-12/h3-6,12H,7-9H2,1-2H3,(H2,14,15)
InChIKey
QCOUMMBCVRRSMN-UHFFFAOYSA-N
Compound name
N'-[2-(dimethylamino)ethoxy]-2,3-dihydro-1,4-benzodioxine-3-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.14264 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.14992 162.8
[M+Na]+ 288.13186 172.0
[M+NH4]+ 283.17646 170.0
[M+K]+ 304.10580 167.4
[M-H]- 264.13536 168.9
[M+Na-2H]- 286.11731 166.4
[M]+ 265.14209 165.5
[M]- 265.14319 165.5
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

No patent data available for this compound.