CID 28799977

N-(4-aminophenyl)-2-(azocan-1-yl)acetamide

Structural Information

Molecular Formula
C15H23N3O
SMILES
C1CCCN(CCC1)CC(=O)NC2=CC=C(C=C2)N
InChI
InChI=1S/C15H23N3O/c16-13-6-8-14(9-7-13)17-15(19)12-18-10-4-2-1-3-5-11-18/h6-9H,1-5,10-12,16H2,(H,17,19)
InChIKey
IANDZERBLXSPOG-UHFFFAOYSA-N
Compound name
N-(4-aminophenyl)-2-(azocan-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.1841 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.19138 155.6
[M+Na]+ 284.17332 158.6
[M-H]- 260.17682 157.5
[M+NH4]+ 279.21792 162.1
[M+K]+ 300.14726 158.2
[M+H-H2O]+ 244.18136 150.9
[M+HCOO]- 306.18230 164.2
[M+CH3COO]- 320.19795 229.5
[M+Na-2H]- 282.15877 155.2
[M]+ 261.18355 152.4
[M]- 261.18465 152.4
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.