CID 62375581

6,8-dimethyl-1,2,3,4-tetrahydroisoquinoline

Structural Information

Molecular Formula
C11H15N
SMILES
CC1=CC(=C2CNCCC2=C1)C
InChI
InChI=1S/C11H15N/c1-8-5-9(2)11-7-12-4-3-10(11)6-8/h5-6,12H,3-4,7H2,1-2H3
InChIKey
ZFPWKVIUPYDEFE-UHFFFAOYSA-N
Compound name
6,8-dimethyl-1,2,3,4-tetrahydroisoquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

161.12045 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.12773 135.2
[M+Na]+ 184.10967 149.0
[M+NH4]+ 179.15427 145.2
[M+K]+ 200.08361 141.2
[M-H]- 160.11317 138.2
[M+Na-2H]- 182.09512 141.8
[M]+ 161.11990 138.1
[M]- 161.12100 138.1
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