CID 3086277

Benzamide, 2-((2-hydroxyethyl)amino)-

Structural Information

Molecular Formula
C9H12N2O2
SMILES
C1=CC=C(C(=C1)C(=O)N)NCCO
InChI
InChI=1S/C9H12N2O2/c10-9(13)7-3-1-2-4-8(7)11-5-6-12/h1-4,11-12H,5-6H2,(H2,10,13)
InChIKey
XVJMMRCIYPAAMO-UHFFFAOYSA-N
Compound name
2-(2-hydroxyethylamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

180.08987 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.09715 137.8
[M+Na]+ 203.07909 143.9
[M-H]- 179.08259 139.7
[M+NH4]+ 198.12369 156.2
[M+K]+ 219.05303 141.6
[M+H-H2O]+ 163.08713 131.6
[M+HCOO]- 225.08807 161.9
[M+CH3COO]- 239.10372 183.2
[M+Na-2H]- 201.06454 143.0
[M]+ 180.08932 135.2
[M]- 180.09042 135.2
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