CID 3121861

303060-73-3

Structural Information

Molecular Formula
C23H26N2O2
SMILES
COC1=CC=C(C=C1)C2=NN3C(C2)C4=CC=CC=C4OC3C5CCCCC5
InChI
InChI=1S/C23H26N2O2/c1-26-18-13-11-16(12-14-18)20-15-21-19-9-5-6-10-22(19)27-23(25(21)24-20)17-7-3-2-4-8-17/h5-6,9-14,17,21,23H,2-4,7-8,15H2,1H3
InChIKey
KIXCOVXKIPOHMD-UHFFFAOYSA-N
Compound name
5-cyclohexyl-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.19943 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.20671 189.8
[M+Na]+ 385.18865 204.7
[M+NH4]+ 380.23325 199.2
[M+K]+ 401.16259 197.3
[M-H]- 361.19215 197.8
[M+Na-2H]- 383.17410 196.2
[M]+ 362.19888 194.4
[M]- 362.19998 194.4
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.