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]+ 283.14412 164.1
[M+Na]+ 305.12606 173.0
[M-H]- 281.12956 169.4
[M+NH4]+ 300.17066 180.5
[M+K]+ 321.10000 167.4
[M+H-H2O]+ 265.13410 156.0
[M+HCOO]- 327.13504 187.5
[M+CH3COO]- 341.15069 176.0
[M+Na-2H]- 303.11151 169.0
[M]+ 282.13629 166.3
[M]- 282.13739 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.