CID 215417

35633-78-4

Structural Information

Molecular Formula
C16H23N3
SMILES
CC1=C(C2=CC=CC=C2N1)CCN3CCC(CC3)N
InChI
InChI=1S/C16H23N3/c1-12-14(15-4-2-3-5-16(15)18-12)8-11-19-9-6-13(17)7-10-19/h2-5,13,18H,6-11,17H2,1H3
InChIKey
YSQNFSCMLLGMGZ-UHFFFAOYSA-N
Compound name
1-[2-(2-methyl-1H-indol-3-yl)ethyl]piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

257.1892 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.19648 161.8
[M+Na]+ 280.17842 168.4
[M-H]- 256.18192 164.6
[M+NH4]+ 275.22302 177.8
[M+K]+ 296.15236 162.2
[M+H-H2O]+ 240.18646 153.2
[M+HCOO]- 302.18740 179.5
[M+CH3COO]- 316.20305 172.0
[M+Na-2H]- 278.16387 164.0
[M]+ 257.18865 157.0
[M]- 257.18975 157.0
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