CID 43224

5-methoxy-3-piperidin-4-yl-1h-indole

Structural Information

Molecular Formula
C14H18N2O
SMILES
COC1=CC2=C(C=C1)NC=C2C3CCNCC3
InChI
InChI=1S/C14H18N2O/c1-17-11-2-3-14-12(8-11)13(9-16-14)10-4-6-15-7-5-10/h2-3,8-10,15-16H,4-7H2,1H3
InChIKey
KRDQQMGVPDMSNR-UHFFFAOYSA-N
Compound name
5-methoxy-3-piperidin-4-yl-1H-indole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

122
Patents

230.1419 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.14918 153.2
[M+Na]+ 253.13112 166.1
[M+NH4]+ 248.17572 161.9
[M+K]+ 269.10506 160.5
[M-H]- 229.13462 156.1
[M+Na-2H]- 251.11657 159.6
[M]+ 230.14135 155.8
[M]- 230.14245 155.8
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