CID 32774

N,n-dibutylbenzamide

Structural Information

Molecular Formula
C15H23NO
SMILES
CCCCN(CCCC)C(=O)C1=CC=CC=C1
InChI
InChI=1S/C15H23NO/c1-3-5-12-16(13-6-4-2)15(17)14-10-8-7-9-11-14/h7-11H,3-6,12-13H2,1-2H3
InChIKey
RYGJQVQEGCQNHM-UHFFFAOYSA-N
Compound name
N,N-dibutylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

434
Patents

233.17796 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.18524 158.7
[M+Na]+ 256.16718 162.9
[M-H]- 232.17068 162.7
[M+NH4]+ 251.21178 176.8
[M+K]+ 272.14112 161.2
[M+H-H2O]+ 216.17522 151.4
[M+HCOO]- 278.17616 182.2
[M+CH3COO]- 292.19181 199.1
[M+Na-2H]- 254.15263 161.9
[M]+ 233.17741 161.3
[M]- 233.17851 161.3
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