CID 3041349

53970-64-2

Structural Information

Molecular Formula
C13H14N2
SMILES
CC1=C2C(=CC=C1)C(=C3CCCC3=N2)N
InChI
InChI=1S/C13H14N2/c1-8-4-2-6-10-12(14)9-5-3-7-11(9)15-13(8)10/h2,4,6H,3,5,7H2,1H3,(H2,14,15)
InChIKey
QOLOQNUWZYKSGE-UHFFFAOYSA-N
Compound name
5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

198.11569 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.12297 142.6
[M+Na]+ 221.10491 152.2
[M-H]- 197.10841 146.7
[M+NH4]+ 216.14951 164.6
[M+K]+ 237.07885 147.4
[M+H-H2O]+ 181.11295 136.2
[M+HCOO]- 243.11389 164.1
[M+CH3COO]- 257.12954 156.0
[M+Na-2H]- 219.09036 148.6
[M]+ 198.11514 140.9
[M]- 198.11624 140.9
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