CID 3044289

Rmi 61193

Structural Information

Molecular Formula
C23H25N3O2
SMILES
CN(C)C(=O)CN1CCN(CC1)C2=CC3=CC=CC=C3C(=O)C4=CC=CC=C42
InChI
InChI=1S/C23H25N3O2/c1-24(2)22(27)16-25-11-13-26(14-12-25)21-15-17-7-3-4-8-18(17)23(28)20-10-6-5-9-19(20)21/h3-10,15H,11-14,16H2,1-2H3
InChIKey
ZGQNTKUELNEJSF-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[4-(2-oxo-9-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)piperazin-1-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

375.19467 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.20195 190.9
[M+Na]+ 398.18389 196.6
[M-H]- 374.18739 198.6
[M+NH4]+ 393.22849 201.8
[M+K]+ 414.15783 196.1
[M+H-H2O]+ 358.19193 181.1
[M+HCOO]- 420.19287 207.0
[M+CH3COO]- 434.20852 199.6
[M+Na-2H]- 396.16934 193.9
[M]+ 375.19412 188.5
[M]- 375.19522 188.5
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.