CID 51707

72808-85-6

Structural Information

Molecular Formula
C17H19ClN2
SMILES
C1CC1CN2CCC(=CC2)N3C=CC4=C3C=CC(=C4)Cl
InChI
InChI=1S/C17H19ClN2/c18-15-3-4-17-14(11-15)5-10-20(17)16-6-8-19(9-7-16)12-13-1-2-13/h3-6,10-11,13H,1-2,7-9,12H2
InChIKey
QNSVMKDCHKKHNY-UHFFFAOYSA-N
Compound name
5-chloro-1-[1-(cyclopropylmethyl)-3,6-dihydro-2H-pyridin-4-yl]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.1237 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.13098 166.1
[M+Na]+ 309.11292 183.6
[M+NH4]+ 304.15752 176.7
[M+K]+ 325.08686 176.7
[M-H]- 285.11642 178.6
[M+Na-2H]- 307.09837 177.4
[M]+ 286.12315 173.7
[M]- 286.12425 173.7
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.