CID 3038911

Indole, 1-(1-cyclohexyloxyethyl)-

Structural Information

Molecular Formula
C16H21NO
SMILES
CC(N1C=CC2=CC=CC=C21)OC3CCCCC3
InChI
InChI=1S/C16H21NO/c1-13(18-15-8-3-2-4-9-15)17-12-11-14-7-5-6-10-16(14)17/h5-7,10-13,15H,2-4,8-9H2,1H3
InChIKey
QNYDVQBITITCPK-UHFFFAOYSA-N
Compound name
1-(1-cyclohexyloxyethyl)indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.16231 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.169586 157.0
[M+Na]+ 266.151528 162.5
[M-H]- 242.155034 162.4
[M+NH4]+ 261.196133 175.4
[M+K]+ 282.125468 158.8
[M+H-H2O]+ 226.159570 148.8
[M+HCOO]- 288.160511 176.3
[M+CH3COO]- 302.176161 168.4
[M+Na-2H]- 264.136976 160.2
[M]+ 243.16176142 155.0
[M]- 243.16285858 155.0
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.