CID 101035

59388-58-8

Structural Information

Molecular Formula
C13H19N
SMILES
CC1CC(NC2=C1C=CC(=C2)C)(C)C
InChI
InChI=1S/C13H19N/c1-9-5-6-11-10(2)8-13(3,4)14-12(11)7-9/h5-7,10,14H,8H2,1-4H3
InChIKey
NRWNXIXJZMSDAU-UHFFFAOYSA-N
Compound name
2,2,4,7-tetramethyl-3,4-dihydro-1H-quinoline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

74
Patents

189.15175 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 144.1
[M+Na]+ 212.14097 158.1
[M+NH4]+ 207.18557 155.3
[M+K]+ 228.11491 148.3
[M-H]- 188.14447 147.1
[M+Na-2H]- 210.12642 151.5
[M]+ 189.15120 147.3
[M]- 189.15230 147.3
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

patents stripe