CID 10607526

2,3-dihydro-1h-phenalen-1-amine hydrochloride

Structural Information

Molecular Formula
C13H13N
SMILES
C1CC2=CC=CC3=C2C(=CC=C3)C1N
InChI
InChI=1S/C13H13N/c14-12-8-7-10-4-1-3-9-5-2-6-11(12)13(9)10/h1-6,12H,7-8,14H2
InChIKey
PJYIGONWNQJLJK-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-phenalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

183.1048 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.112076 137.4
[M+Na]+ 206.094018 145.0
[M-H]- 182.097524 141.5
[M+NH4]+ 201.138623 159.3
[M+K]+ 222.067958 140.6
[M+H-H2O]+ 166.102060 131.2
[M+HCOO]- 228.103001 158.0
[M+CH3COO]- 242.118651 150.4
[M+Na-2H]- 204.079466 146.3
[M]+ 183.10425142 134.3
[M]- 183.10534858 134.3
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