CID 22690418

2-amino-n-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide hydrochloride

Structural Information

Molecular Formula
C10H12N2O3
SMILES
C1COC2=C(O1)C=CC(=C2)NC(=O)CN
InChI
InChI=1S/C10H12N2O3/c11-6-10(13)12-7-1-2-8-9(5-7)15-4-3-14-8/h1-2,5H,3-4,6,11H2,(H,12,13)
InChIKey
OALNAFYHRTUHOY-UHFFFAOYSA-N
Compound name
2-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.0848 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.09208 144.0
[M+Na]+ 231.07402 149.8
[M-H]- 207.07752 149.0
[M+NH4]+ 226.11862 160.2
[M+K]+ 247.04796 150.1
[M+H-H2O]+ 191.08206 137.1
[M+HCOO]- 253.08300 164.6
[M+CH3COO]- 267.09865 188.8
[M+Na-2H]- 229.05947 152.4
[M]+ 208.08425 142.4
[M]- 208.08535 142.4
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.