CID 5052878

303059-85-0

Structural Information

Molecular Formula
C23H22N2O
SMILES
CCCC1N2C(CC(=N2)C3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5O1
InChI
InChI=1S/C23H22N2O/c1-2-7-23-25-21(19-10-5-6-11-22(19)26-23)15-20(24-25)18-13-12-16-8-3-4-9-17(16)14-18/h3-6,8-14,21,23H,2,7,15H2,1H3
InChIKey
PHWIMVMNWHJCBG-UHFFFAOYSA-N
Compound name
2-naphthalen-2-yl-5-propyl-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

342.17322 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.18050 183.6
[M+Na]+ 365.16244 191.8
[M-H]- 341.16594 190.3
[M+NH4]+ 360.20704 197.4
[M+K]+ 381.13638 185.3
[M+H-H2O]+ 325.17048 172.9
[M+HCOO]- 387.17142 198.3
[M+CH3COO]- 401.18707 193.4
[M+Na-2H]- 363.14789 187.4
[M]+ 342.17267 183.8
[M]- 342.17377 183.8
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.