CID 116139

Brn 3330909

Structural Information

Molecular Formula
C15H15NO3
SMILES
C1=CC=C(C=C1)C2=C(C(=CC=C2)C(=O)NCCO)O
InChI
InChI=1S/C15H15NO3/c17-10-9-16-15(19)13-8-4-7-12(14(13)18)11-5-2-1-3-6-11/h1-8,17-18H,9-10H2,(H,16,19)
InChIKey
BJLUMCCGHWLDON-UHFFFAOYSA-N
Compound name
2-hydroxy-N-(2-hydroxyethyl)-3-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.1052 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.11248 157.7
[M+Na]+ 280.09442 163.8
[M-H]- 256.09792 161.8
[M+NH4]+ 275.13902 172.7
[M+K]+ 296.06836 159.6
[M+H-H2O]+ 240.10246 150.3
[M+HCOO]- 302.10340 179.6
[M+CH3COO]- 316.11905 192.9
[M+Na-2H]- 278.07987 162.0
[M]+ 257.10465 156.3
[M]- 257.10575 156.3
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