CID 18069742

2-(2,3-dihydro-1h-indol-1-ylmethyl)aniline

Structural Information

Molecular Formula
C15H16N2
SMILES
C1CN(C2=CC=CC=C21)CC3=CC=CC=C3N
InChI
InChI=1S/C15H16N2/c16-14-7-3-1-6-13(14)11-17-10-9-12-5-2-4-8-15(12)17/h1-8H,9-11,16H2
InChIKey
CEWQIFHKJLVCAQ-UHFFFAOYSA-N
Compound name
2-(2,3-dihydroindol-1-ylmethyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.13135 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13863 150.2
[M+Na]+ 247.12057 157.9
[M-H]- 223.12407 156.0
[M+NH4]+ 242.16517 169.4
[M+K]+ 263.09451 152.7
[M+H-H2O]+ 207.12861 142.4
[M+HCOO]- 269.12955 172.7
[M+CH3COO]- 283.14520 162.6
[M+Na-2H]- 245.10602 155.2
[M]+ 224.13080 147.4
[M]- 224.13190 147.4
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.