CID 3043616

55875-57-5

Structural Information

Molecular Formula
C13H20N2
SMILES
CC(CC1=CC2=C(C=C1)N(CCC2)C)N
InChI
InChI=1S/C13H20N2/c1-10(14)8-11-5-6-13-12(9-11)4-3-7-15(13)2/h5-6,9-10H,3-4,7-8,14H2,1-2H3
InChIKey
SHRNQTPSBJMGFI-UHFFFAOYSA-N
Compound name
1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

204.16264 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.169916 148.6
[M+Na]+ 227.151858 154.4
[M-H]- 203.155364 150.6
[M+NH4]+ 222.196463 167.1
[M+K]+ 243.125798 151.1
[M+H-H2O]+ 187.159900 141.5
[M+HCOO]- 249.160841 166.9
[M+CH3COO]- 263.176491 191.4
[M+Na-2H]- 225.137306 152.6
[M]+ 204.16209142 144.7
[M]- 204.16318858 144.7
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