CID 155315

1,2,3,4-tetrahydroacridine

Structural Information

Molecular Formula
C13H13N
SMILES
C1CCC2=NC3=CC=CC=C3C=C2C1
InChI
InChI=1S/C13H13N/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1,3,5,7,9H,2,4,6,8H2
InChIKey
RXBYRTSOWREATF-UHFFFAOYSA-N
Compound name
1,2,3,4-tetrahydroacridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

13
References

2696
Patents

183.1048 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.112076 137.5
[M+Na]+ 206.094018 144.9
[M-H]- 182.097524 140.9
[M+NH4]+ 201.138623 157.9
[M+K]+ 222.067958 140.5
[M+H-H2O]+ 166.102060 130.0
[M+HCOO]- 228.103001 156.2
[M+CH3COO]- 242.118651 150.0
[M+Na-2H]- 204.079466 147.2
[M]+ 183.10425142 134.1
[M]- 183.10534858 134.1
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