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

10
Patents

180.08987 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.097146 137.8
[M+Na]+ 203.079088 143.9
[M-H]- 179.082594 139.7
[M+NH4]+ 198.123693 156.2
[M+K]+ 219.053028 141.6
[M+H-H2O]+ 163.087130 131.6
[M+HCOO]- 225.088071 161.9
[M+CH3COO]- 239.103721 183.2
[M+Na-2H]- 201.064536 143.0
[M]+ 180.08932142 135.2
[M]- 180.09041858 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