CID 205539

6-(3-(dimethylamino)propyl)-5,6,7,12-tetrahydro-dibenz(c,f)azocine dimaleate

Structural Information

Molecular Formula
C20H26N2
SMILES
CN(C)CCCN1CC2=CC=CC=C2CC3=CC=CC=C3C1
InChI
InChI=1S/C20H26N2/c1-21(2)12-7-13-22-15-19-10-5-3-8-17(19)14-18-9-4-6-11-20(18)16-22/h3-6,8-11H,7,12-16H2,1-2H3
InChIKey
WSYBYCPXNLBLDR-UHFFFAOYSA-N
Compound name
3-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.2096 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.21688 165.4
[M+Na]+ 317.19882 169.8
[M+NH4]+ 312.24342 168.5
[M+K]+ 333.17276 167.3
[M-H]- 293.20232 167.0
[M+Na-2H]- 315.18427 168.1
[M]+ 294.20905 166.5
[M]- 294.21015 166.5
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.