CID 27434

Of 2528

Structural Information

Molecular Formula
C23H30N2O
SMILES
CC1=CC2=C(C=C1)N(C3=C2CCCC3=O)CC4CCCN5C4CCCC5
InChI
InChI=1S/C23H30N2O/c1-16-10-11-21-19(14-16)18-7-4-9-22(26)23(18)25(21)15-17-6-5-13-24-12-3-2-8-20(17)24/h10-11,14,17,20H,2-9,12-13,15H2,1H3
InChIKey
ZNQDDRUFSYBTDR-UHFFFAOYSA-N
Compound name
9-(2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl)-6-methyl-3,4-dihydro-2H-carbazol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.2358 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.243076 188.0
[M+Na]+ 373.225018 192.8
[M-H]- 349.228524 192.6
[M+NH4]+ 368.269623 202.6
[M+K]+ 389.198958 185.4
[M+H-H2O]+ 333.233060 177.2
[M+HCOO]- 395.234001 197.8
[M+CH3COO]- 409.249651 195.6
[M+Na-2H]- 371.210466 186.5
[M]+ 350.23525142 181.5
[M]- 350.23634858 181.5
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.