CID 20428348

2,7-dimethyl-1,2,3,4-tetrahydroquinoline

Structural Information

Molecular Formula
C11H15N
SMILES
CC1CCC2=C(N1)C=C(C=C2)C
InChI
InChI=1S/C11H15N/c1-8-3-5-10-6-4-9(2)12-11(10)7-8/h3,5,7,9,12H,4,6H2,1-2H3
InChIKey
XIFZARBGEUHEHW-UHFFFAOYSA-N
Compound name
2,7-dimethyl-1,2,3,4-tetrahydroquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

161.12045 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.12773 134.9
[M+Na]+ 184.10967 142.4
[M-H]- 160.11317 136.5
[M+NH4]+ 179.15427 155.2
[M+K]+ 200.08361 138.6
[M+H-H2O]+ 144.11771 128.8
[M+HCOO]- 206.11865 153.1
[M+CH3COO]- 220.13430 147.5
[M+Na-2H]- 182.09512 141.5
[M]+ 161.11990 130.9
[M]- 161.12100 130.9
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