CID 3326675

1-(1h-indol-2-yl)ethan-1-ol

Structural Information

Molecular Formula
C10H11NO
SMILES
CC(C1=CC2=CC=CC=C2N1)O
InChI
InChI=1S/C10H11NO/c1-7(12)10-6-8-4-2-3-5-9(8)11-10/h2-7,11-12H,1H3
InChIKey
AYDNGOXYPCMWIS-UHFFFAOYSA-N
Compound name
1-(1H-indol-2-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

155
Patents

161.08406 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.091336 132.4
[M+Na]+ 184.073278 141.7
[M-H]- 160.076784 133.7
[M+NH4]+ 179.117883 153.7
[M+K]+ 200.047218 137.8
[M+H-H2O]+ 144.081320 127.0
[M+HCOO]- 206.082261 153.8
[M+CH3COO]- 220.097911 146.0
[M+Na-2H]- 182.058726 139.0
[M]+ 161.08351142 131.7
[M]- 161.08460858 131.7
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