CID 58998

1-methyl-1,2,3,9a-tetrahydro-1-azafluorene hydrochloride

Structural Information

Molecular Formula
C13H15N
SMILES
CN1CCC=C2C1CC3=CC=CC=C32
InChI
InChI=1S/C13H15N/c1-14-8-4-7-12-11-6-3-2-5-10(11)9-13(12)14/h2-3,5-7,13H,4,8-9H2,1H3
InChIKey
RYXRBWDSOWSEGS-UHFFFAOYSA-N
Compound name
1-methyl-2,3,9,9a-tetrahydroindeno[2,1-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.12045 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.12773 140.3
[M+Na]+ 208.10967 148.7
[M-H]- 184.11317 144.2
[M+NH4]+ 203.15427 163.0
[M+K]+ 224.08361 144.5
[M+H-H2O]+ 168.11771 133.8
[M+HCOO]- 230.11865 159.9
[M+CH3COO]- 244.13430 153.5
[M+Na-2H]- 206.09512 146.3
[M]+ 185.11990 138.3
[M]- 185.12100 138.3
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

No patent data available for this compound.