CID 458761

4-amino-n-(2-hydroxyethyl)benzamide

Structural Information

Molecular Formula
C9H12N2O2
SMILES
C1=CC(=CC=C1C(=O)NCCO)N
InChI
InChI=1S/C9H12N2O2/c10-8-3-1-7(2-4-8)9(13)11-5-6-12/h1-4,12H,5-6,10H2,(H,11,13)
InChIKey
YECHMIOBPCMIGF-UHFFFAOYSA-N
Compound name
4-amino-N-(2-hydroxyethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

205
Patents

180.08987 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.09715 138.7
[M+Na]+ 203.07909 148.4
[M+NH4]+ 198.12369 145.8
[M+K]+ 219.05303 143.6
[M-H]- 179.08259 140.4
[M+Na-2H]- 201.06454 144.1
[M]+ 180.08932 140.2
[M]- 180.09042 140.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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