CID 4980

Psilocin

Structural Information

Molecular Formula
C12H16N2O
SMILES
CN(C)CCC1=CNC2=C1C(=CC=C2)O
InChI
InChI=1S/C12H16N2O/c1-14(2)7-6-9-8-13-10-4-3-5-11(15)12(9)10/h3-5,8,13,15H,6-7H2,1-2H3
InChIKey
SPCIYGNTAMCTRO-UHFFFAOYSA-N
Compound name
3-[2-(dimethylamino)ethyl]-1H-indol-4-ol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

153
References

3071
Patents

204.12627 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.13355 144.9
[M+Na]+ 227.11549 157.0
[M+NH4]+ 222.16009 153.3
[M+K]+ 243.08943 152.4
[M-H]- 203.11899 146.9
[M+Na-2H]- 225.10094 150.7
[M]+ 204.12572 147.0
[M]- 204.12682 147.0
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