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]+ 244.16959 157.0
[M+Na]+ 266.15153 162.5
[M-H]- 242.15503 162.4
[M+NH4]+ 261.19613 175.4
[M+K]+ 282.12547 158.8
[M+H-H2O]+ 226.15957 148.8
[M+HCOO]- 288.16051 176.3
[M+CH3COO]- 302.17616 168.4
[M+Na-2H]- 264.13698 160.2
[M]+ 243.16176 155.0
[M]- 243.16286 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.