CID 3066918

Benzamide, n-(4-(methylamino)-1-phenylbutyl)-4-methyl-, hydrochloride

Structural Information

Molecular Formula
C20H26N2O
SMILES
CC1=CC=C(C=C1)C(=O)NC(CCCN(C)C)C2=CC=CC=C2
InChI
InChI=1S/C20H26N2O/c1-16-11-13-18(14-12-16)20(23)21-19(10-7-15-22(2)3)17-8-5-4-6-9-17/h4-6,8-9,11-14,19H,7,10,15H2,1-3H3,(H,21,23)
InChIKey
AHMFLHZEVRDUDH-UHFFFAOYSA-N
Compound name
N-[4-(dimethylamino)-1-phenylbutyl]-4-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.2045 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.211776 178.5
[M+Na]+ 333.193718 181.5
[M-H]- 309.197224 185.5
[M+NH4]+ 328.238323 192.7
[M+K]+ 349.167658 178.5
[M+H-H2O]+ 293.201760 169.3
[M+HCOO]- 355.202701 201.7
[M+CH3COO]- 369.218351 216.6
[M+Na-2H]- 331.179166 180.1
[M]+ 310.20395142 179.2
[M]- 310.20504858 179.2
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

No patent data available for this compound.