CID 161462

Adepren

Structural Information

Molecular Formula
C10H12N2
SMILES
CN1CCC(=N)C2=CC=CC=C21
InChI
InChI=1S/C10H12N2/c1-12-7-6-9(11)8-4-2-3-5-10(8)12/h2-5,11H,6-7H2,1H3
InChIKey
GKGBJWPUGWCYNT-UHFFFAOYSA-N
Compound name
1-methyl-2,3-dihydroquinolin-4-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

34
Patents

160.10005 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.10733 132.4
[M+Na]+ 183.08927 140.1
[M-H]- 159.09277 135.5
[M+NH4]+ 178.13387 152.9
[M+K]+ 199.06321 136.8
[M+H-H2O]+ 143.09731 125.8
[M+HCOO]- 205.09825 153.6
[M+CH3COO]- 219.11390 181.2
[M+Na-2H]- 181.07472 140.4
[M]+ 160.09950 128.4
[M]- 160.10060 128.4
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.