CID 13497477

6-phenyl-1,2,3,4-tetrahydroquinoline hydrochloride

Structural Information

Molecular Formula
C15H15N
SMILES
C1CC2=C(C=CC(=C2)C3=CC=CC=C3)NC1
InChI
InChI=1S/C15H15N/c1-2-5-12(6-3-1)13-8-9-15-14(11-13)7-4-10-16-15/h1-3,5-6,8-9,11,16H,4,7,10H2
InChIKey
GNGJIQPRSRXTFE-UHFFFAOYSA-N
Compound name
6-phenyl-1,2,3,4-tetrahydroquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

209.12045 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.12773 146.2
[M+Na]+ 232.10967 152.3
[M-H]- 208.11317 150.2
[M+NH4]+ 227.15427 163.5
[M+K]+ 248.08361 146.6
[M+H-H2O]+ 192.11771 138.1
[M+HCOO]- 254.11865 164.3
[M+CH3COO]- 268.13430 157.5
[M+Na-2H]- 230.09512 153.8
[M]+ 209.11990 140.4
[M]- 209.12100 140.4
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