CID 83854675

2-methyl-5,6,7,8-tetrahydroquinoline-4-carbaldehyde

Structural Information

Molecular Formula
C11H13NO
SMILES
CC1=CC(=C2CCCCC2=N1)C=O
InChI
InChI=1S/C11H13NO/c1-8-6-9(7-13)10-4-2-3-5-11(10)12-8/h6-7H,2-5H2,1H3
InChIKey
OJCZPYXJCAQNJJ-UHFFFAOYSA-N
Compound name
2-methyl-5,6,7,8-tetrahydroquinoline-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

175.09972 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.106996 136.3
[M+Na]+ 198.088938 144.5
[M-H]- 174.092444 139.3
[M+NH4]+ 193.133543 156.6
[M+K]+ 214.062878 141.5
[M+H-H2O]+ 158.096980 129.7
[M+HCOO]- 220.097921 156.4
[M+CH3COO]- 234.113571 181.5
[M+Na-2H]- 196.074386 143.4
[M]+ 175.09917142 134.9
[M]- 175.10026858 134.9
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