CID 3043116

3-indolemethanol, 5-methoxy-alpha-(3-pyridyl)-

Structural Information

Molecular Formula
C15H14N2O2
SMILES
COC1=CC2=C(C=C1)NC=C2C(C3=CN=CC=C3)O
InChI
InChI=1S/C15H14N2O2/c1-19-11-4-5-14-12(7-11)13(9-17-14)15(18)10-3-2-6-16-8-10/h2-9,15,17-18H,1H3
InChIKey
GJHYWZUGUACJGJ-UHFFFAOYSA-N
Compound name
(5-methoxy-1H-indol-3-yl)-pyridin-3-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

254.10553 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.112806 156.1
[M+Na]+ 277.094748 165.2
[M-H]- 253.098254 159.3
[M+NH4]+ 272.139353 171.8
[M+K]+ 293.068688 159.9
[M+H-H2O]+ 237.102790 148.1
[M+HCOO]- 299.103731 176.0
[M+CH3COO]- 313.119381 167.9
[M+Na-2H]- 275.080196 161.6
[M]+ 254.10498142 156.9
[M]- 254.10607858 156.9
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