CID 3056344

6,6-dimethyl-1,3,4,6,7,7a,8,9,10,11,11a,11b-dodecahydro-2h-benzo(a)quinolizine

Structural Information

Molecular Formula
C15H27N
SMILES
CC1(CC2CCCCC2C3N1CCCC3)C
InChI
InChI=1S/C15H27N/c1-15(2)11-12-7-3-4-8-13(12)14-9-5-6-10-16(14)15/h12-14H,3-11H2,1-2H3
InChIKey
ZEARQHOSNUZRHD-UHFFFAOYSA-N
Compound name
6,6-dimethyl-1,2,3,4,7,7a,8,9,10,11,11a,11b-dodecahydrobenzo[a]quinolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.21436 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.221636 156.2
[M+Na]+ 244.203578 159.3
[M-H]- 220.207084 157.8
[M+NH4]+ 239.248183 176.9
[M+K]+ 260.177518 155.7
[M+H-H2O]+ 204.211620 148.4
[M+HCOO]- 266.212561 166.7
[M+CH3COO]- 280.228211 165.5
[M+Na-2H]- 242.189026 159.3
[M]+ 221.21381142 146.7
[M]- 221.21490858 146.7
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.