CID 118068

N-phenylindan-2-amine

Structural Information

Molecular Formula
C15H15N
SMILES
C1C(CC2=CC=CC=C21)NC3=CC=CC=C3
InChI
InChI=1S/C15H15N/c1-2-8-14(9-3-1)16-15-10-12-6-4-5-7-13(12)11-15/h1-9,15-16H,10-11H2
InChIKey
MHVHCDLCLNXADJ-UHFFFAOYSA-N
Compound name
N-phenyl-2,3-dihydro-1H-inden-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

209.12045 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.12773 144.9
[M+Na]+ 232.10967 151.7
[M-H]- 208.11317 152.3
[M+NH4]+ 227.15427 166.1
[M+K]+ 248.08361 146.9
[M+H-H2O]+ 192.11771 138.0
[M+HCOO]- 254.11865 169.3
[M+CH3COO]- 268.13430 158.1
[M+Na-2H]- 230.09512 151.7
[M]+ 209.11990 142.2
[M]- 209.12100 142.2
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