CID 82657

10479-30-8

Structural Information

Molecular Formula
C16H17NO
SMILES
CC(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2
InChI
InChI=1S/C16H17NO/c1-14(18)17(12-15-8-4-2-5-9-15)13-16-10-6-3-7-11-16/h2-11H,12-13H2,1H3
InChIKey
JJGMIJNIKHHXHK-UHFFFAOYSA-N
Compound name
N,N-dibenzylacetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

126
Patents

239.13101 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.13829 156.0
[M+Na]+ 262.12023 161.0
[M-H]- 238.12373 163.4
[M+NH4]+ 257.16483 173.3
[M+K]+ 278.09417 158.4
[M+H-H2O]+ 222.12827 147.7
[M+HCOO]- 284.12921 180.6
[M+CH3COO]- 298.14486 197.7
[M+Na-2H]- 260.10568 161.3
[M]+ 239.13046 156.3
[M]- 239.13156 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

literature stripe

Patent stripe

patents stripe