CID 482838

2-[(3-amino-2-phenyl-indol-1-yl)methoxy]ethanol

Structural Information

Molecular Formula
C17H18N2O2
SMILES
C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2COCCO)N
InChI
InChI=1S/C17H18N2O2/c18-16-14-8-4-5-9-15(14)19(12-21-11-10-20)17(16)13-6-2-1-3-7-13/h1-9,20H,10-12,18H2
InChIKey
KFDROBLTCNQSRW-UHFFFAOYSA-N
Compound name
2-[(3-amino-2-phenylindol-1-yl)methoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

282.13684 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.144116 164.1
[M+Na]+ 305.126058 173.0
[M-H]- 281.129564 169.4
[M+NH4]+ 300.170663 180.5
[M+K]+ 321.099998 167.4
[M+H-H2O]+ 265.134100 156.0
[M+HCOO]- 327.135041 187.5
[M+CH3COO]- 341.150691 176.0
[M+Na-2H]- 303.111506 169.0
[M]+ 282.13629142 166.3
[M]- 282.13738858 166.3
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

No patent data available for this compound.