CID 8579

Butylphenamide

Structural Information

Molecular Formula
C17H19NO2
SMILES
CCCCNC(=O)C1=CC=CC(=C1O)C2=CC=CC=C2
InChI
InChI=1S/C17H19NO2/c1-2-3-12-18-17(20)15-11-7-10-14(16(15)19)13-8-5-4-6-9-13/h4-11,19H,2-3,12H2,1H3,(H,18,20)
InChIKey
MNUMSBAWEGBPMH-UHFFFAOYSA-N
Compound name
N-butyl-2-hydroxy-3-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

269.14157 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.14885 163.6
[M+Na]+ 292.13079 169.4
[M-H]- 268.13429 168.7
[M+NH4]+ 287.17539 178.9
[M+K]+ 308.10473 164.9
[M+H-H2O]+ 252.13883 155.8
[M+HCOO]- 314.13977 186.1
[M+CH3COO]- 328.15542 199.2
[M+Na-2H]- 290.11624 167.2
[M]+ 269.14102 163.3
[M]- 269.14212 163.3
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

patents stripe