CID 62547

1,2-dihydroacenaphthylen-5-amine

Structural Information

Molecular Formula
C12H11N
SMILES
C1CC2=CC=C(C3=CC=CC1=C23)N
InChI
InChI=1S/C12H11N/c13-11-7-6-9-5-4-8-2-1-3-10(11)12(8)9/h1-3,6-7H,4-5,13H2
InChIKey
JEUAWMJVEYFVNJ-UHFFFAOYSA-N
Compound name
1,2-dihydroacenaphthylen-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

116
Patents

169.08914 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.09642 133.0
[M+Na]+ 192.07836 146.7
[M+NH4]+ 187.12296 144.5
[M+K]+ 208.05230 140.3
[M-H]- 168.08186 137.3
[M+Na-2H]- 190.06381 139.6
[M]+ 169.08859 136.3
[M]- 169.08969 136.3
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