CID 3078987

Butanamide, n-(1,2,3,4-tetrahydro-9-acridinyl)-

Structural Information

Molecular Formula
C17H20N2O
SMILES
CCCC(=O)NC1=C2CCCCC2=NC3=CC=CC=C31
InChI
InChI=1S/C17H20N2O/c1-2-7-16(20)19-17-12-8-3-5-10-14(12)18-15-11-6-4-9-13(15)17/h3,5,8,10H,2,4,6-7,9,11H2,1H3,(H,18,19,20)
InChIKey
HHGNFMTUNLFUTN-UHFFFAOYSA-N
Compound name
N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

268.15756 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.16484 162.1
[M+Na]+ 291.14678 167.7
[M-H]- 267.15028 165.0
[M+NH4]+ 286.19138 178.8
[M+K]+ 307.12072 162.9
[M+H-H2O]+ 251.15482 153.7
[M+HCOO]- 313.15576 179.8
[M+CH3COO]- 327.17141 172.4
[M+Na-2H]- 289.13223 168.2
[M]+ 268.15701 159.9
[M]- 268.15811 159.9
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

patents stripe