CID 32489

Lm 2927

Structural Information

Molecular Formula
C21H22N2O2
SMILES
C1COCCN1CCON=C2C3=CC=CC=C3C=CC4=CC=CC=C42
InChI
InChI=1S/C21H22N2O2/c1-3-7-19-17(5-1)9-10-18-6-2-4-8-20(18)21(19)22-25-16-13-23-11-14-24-15-12-23/h1-10H,11-16H2
InChIKey
SXSIETVXGBIAJH-UHFFFAOYSA-N
Compound name
N-(2-morpholin-4-ylethoxy)tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaen-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.16812 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.17540 183.4
[M+Na]+ 357.15734 196.7
[M+NH4]+ 352.20194 191.6
[M+K]+ 373.13128 188.4
[M-H]- 333.16084 190.3
[M+Na-2H]- 355.14279 190.9
[M]+ 334.16757 187.5
[M]- 334.16867 187.5
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.