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

3
Patents

209.12045 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.127726 146.2
[M+Na]+ 232.109668 152.3
[M-H]- 208.113174 150.2
[M+NH4]+ 227.154273 163.5
[M+K]+ 248.083608 146.6
[M+H-H2O]+ 192.117710 138.1
[M+HCOO]- 254.118651 164.3
[M+CH3COO]- 268.134301 157.5
[M+Na-2H]- 230.095116 153.8
[M]+ 209.11990142 140.4
[M]- 209.12099858 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