CID 214553

Phenalen-2-amine, 2,3-dihydro-, hydrochloride

Structural Information

Molecular Formula
C13H13N
SMILES
C1C(CC2=CC=CC3=C2C1=CC=C3)N
InChI
InChI=1S/C13H13N/c14-12-7-10-5-1-3-9-4-2-6-11(8-12)13(9)10/h1-6,12H,7-8,14H2
InChIKey
RLHOXZHHYHCXOY-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-phenalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

183.1048 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.11208 137.4
[M+Na]+ 206.09402 145.0
[M-H]- 182.09752 141.5
[M+NH4]+ 201.13862 159.3
[M+K]+ 222.06796 140.6
[M+H-H2O]+ 166.10206 131.2
[M+HCOO]- 228.10300 158.0
[M+CH3COO]- 242.11865 150.4
[M+Na-2H]- 204.07947 146.3
[M]+ 183.10425 134.3
[M]- 183.10535 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