CID 16784749

925905-07-3

Structural Information

Molecular Formula
C15H16N2
SMILES
C1CN(C2=CC=CC=C21)CC3=CC=C(C=C3)N
InChI
InChI=1S/C15H16N2/c16-14-7-5-12(6-8-14)11-17-10-9-13-3-1-2-4-15(13)17/h1-8H,9-11,16H2
InChIKey
YRCYUXVUZBJHOT-UHFFFAOYSA-N
Compound name
4-(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]+ 225.138626 150.2
[M+Na]+ 247.120568 157.9
[M-H]- 223.124074 156.0
[M+NH4]+ 242.165173 169.4
[M+K]+ 263.094508 152.7
[M+H-H2O]+ 207.128610 142.4
[M+HCOO]- 269.129551 172.7
[M+CH3COO]- 283.145201 162.6
[M+Na-2H]- 245.106016 155.2
[M]+ 224.13080142 147.4
[M]- 224.13189858 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.