CID 22462569

1-methyl-3-(1,2,3,6-tetrahydropyridin-4-yl)-1h-indole hydrochloride

Structural Information

Molecular Formula
C14H16N2
SMILES
CN1C=C(C2=CC=CC=C21)C3=CCNCC3
InChI
InChI=1S/C14H16N2/c1-16-10-13(11-6-8-15-9-7-11)12-4-2-3-5-14(12)16/h2-6,10,15H,7-9H2,1H3
InChIKey
IYVSWFIJIOPUDN-UHFFFAOYSA-N
Compound name
1-methyl-3-(1,2,3,6-tetrahydropyridin-4-yl)indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

212.13135 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.13863 148.1
[M+Na]+ 235.12057 162.9
[M+NH4]+ 230.16517 157.7
[M+K]+ 251.09451 156.3
[M-H]- 211.12407 152.2
[M+Na-2H]- 233.10602 156.4
[M]+ 212.13080 151.4
[M]- 212.13190 151.4
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

patents stripe