CID 54607

80704-45-6

Structural Information

Molecular Formula
C14H22N2O
SMILES
CC(=O)NC(CCCN(C)C)C1=CC=CC=C1
InChI
InChI=1S/C14H22N2O/c1-12(17)15-14(10-7-11-16(2)3)13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-11H2,1-3H3,(H,15,17)
InChIKey
NYIGZNRKGBCDJB-UHFFFAOYSA-N
Compound name
N-[4-(dimethylamino)-1-phenylbutyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.17322 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.180496 158.6
[M+Na]+ 257.162438 162.1
[M-H]- 233.165944 162.8
[M+NH4]+ 252.207043 176.2
[M+K]+ 273.136378 161.2
[M+H-H2O]+ 217.170480 151.1
[M+HCOO]- 279.171421 182.5
[M+CH3COO]- 293.187071 201.9
[M+Na-2H]- 255.147886 161.4
[M]+ 234.17267142 159.5
[M]- 234.17376858 159.5
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.