CID 92671

57120-87-3

Structural Information

Molecular Formula
C15H19N
SMILES
C1CCN2C=C(CCC2C1)C3=CC=CC=C3
InChI
InChI=1S/C15H19N/c1-2-6-13(7-3-1)14-9-10-15-8-4-5-11-16(15)12-14/h1-3,6-7,12,15H,4-5,8-11H2
InChIKey
AMNIUADSZBSURC-UHFFFAOYSA-N
Compound name
7-phenyl-2,3,4,8,9,9a-hexahydro-1H-quinolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.15175 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.15903 149.0
[M+Na]+ 236.14097 153.3
[M-H]- 212.14447 153.6
[M+NH4]+ 231.18557 166.6
[M+K]+ 252.11491 149.0
[M+H-H2O]+ 196.14901 140.3
[M+HCOO]- 258.14995 165.7
[M+CH3COO]- 272.16560 159.8
[M+Na-2H]- 234.12642 154.8
[M]+ 213.15120 142.0
[M]- 213.15230 142.0
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

No patent data available for this compound.