CID 83248

1-ethyl-2-phenylindole

Structural Information

Molecular Formula
C16H15N
SMILES
CCN1C2=CC=CC=C2C=C1C3=CC=CC=C3
InChI
InChI=1S/C16H15N/c1-2-17-15-11-7-6-10-14(15)12-16(17)13-8-4-3-5-9-13/h3-12H,2H2,1H3
InChIKey
RAKSXVONTIQCGY-UHFFFAOYSA-N
Compound name
1-ethyl-2-phenylindole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

354
Patents

221.12045 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.127726 149.0
[M+Na]+ 244.109668 159.2
[M-H]- 220.113174 156.0
[M+NH4]+ 239.154273 169.2
[M+K]+ 260.083608 153.8
[M+H-H2O]+ 204.117710 141.4
[M+HCOO]- 266.118651 173.6
[M+CH3COO]- 280.134301 162.9
[M+Na-2H]- 242.095116 155.9
[M]+ 221.11990142 151.1
[M]- 221.12099858 151.1
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