CID 213640

26844-39-3

Structural Information

Molecular Formula
C16H23N3
SMILES
CN1C=C(C2=CC=CC=C21)CCN3CCC(CC3)N
InChI
InChI=1S/C16H23N3/c1-18-12-13(15-4-2-3-5-16(15)18)6-9-19-10-7-14(17)8-11-19/h2-5,12,14H,6-11,17H2,1H3
InChIKey
PZYZQAHSVDUKSA-UHFFFAOYSA-N
Compound name
1-[2-(1-methylindol-3-yl)ethyl]piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

257.1892 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.19648 161.7
[M+Na]+ 280.17842 168.8
[M-H]- 256.18192 165.9
[M+NH4]+ 275.22302 178.5
[M+K]+ 296.15236 163.4
[M+H-H2O]+ 240.18646 152.8
[M+HCOO]- 302.18740 181.0
[M+CH3COO]- 316.20305 172.7
[M+Na-2H]- 278.16387 164.3
[M]+ 257.18865 158.8
[M]- 257.18975 158.8
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