CID 13497475

5-phenyl-2,3-dihydro-1h-indole

Structural Information

Molecular Formula
C14H13N
SMILES
C1CNC2=C1C=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C14H13N/c1-2-4-11(5-3-1)12-6-7-14-13(10-12)8-9-15-14/h1-7,10,15H,8-9H2
InChIKey
OTLWHHHZQLDXEK-UHFFFAOYSA-N
Compound name
5-phenyl-2,3-dihydro-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

195.1048 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.11208 142.0
[M+Na]+ 218.09402 149.7
[M-H]- 194.09752 146.8
[M+NH4]+ 213.13862 162.0
[M+K]+ 234.06796 144.2
[M+H-H2O]+ 178.10206 134.8
[M+HCOO]- 240.10300 162.9
[M+CH3COO]- 254.11865 154.7
[M+Na-2H]- 216.07947 148.3
[M]+ 195.10425 138.3
[M]- 195.10535 138.3
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

patents stripe