CID 21722

Iprindole

Structural Information

Molecular Formula
C19H28N2
SMILES
CN(C)CCCN1C2=C(CCCCCC2)C3=CC=CC=C31
InChI
InChI=1S/C19H28N2/c1-20(2)14-9-15-21-18-12-6-4-3-5-10-16(18)17-11-7-8-13-19(17)21/h7-8,11,13H,3-6,9-10,12,14-15H2,1-2H3
InChIKey
PLIGPBGDXASWPX-UHFFFAOYSA-N
Compound name
3-(6,7,8,9,10,11-hexahydrocycloocta[b]indol-5-yl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

196
References

5719
Patents

284.22525 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.23253 166.1
[M+Na]+ 307.21447 169.8
[M+NH4]+ 302.25907 169.1
[M+K]+ 323.18841 168.1
[M-H]- 283.21797 167.3
[M+Na-2H]- 305.19992 168.1
[M]+ 284.22470 166.9
[M]- 284.22580 166.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe