CID 64174

Is 3330

Structural Information

Molecular Formula
C25H30N2O
SMILES
C1CCC2(CC1)N3CC4(CN2CC(C3)(C4O)C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C25H30N2O/c28-22-23(20-10-4-1-5-11-20)16-26-18-24(22,21-12-6-2-7-13-21)19-27(17-23)25(26)14-8-3-9-15-25/h1-2,4-7,10-13,22,28H,3,8-9,14-19H2
InChIKey
DTZLHGCRNCEIQV-UHFFFAOYSA-N
Compound name
5,7-diphenylspiro[1,3-diazatricyclo[3.3.1.13,7]decane-2,1'-cyclohexane]-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.2358 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.24308 185.9
[M+Na]+ 397.22502 186.6
[M-H]- 373.22852 184.8
[M+NH4]+ 392.26962 203.6
[M+K]+ 413.19896 179.4
[M+H-H2O]+ 357.23306 168.5
[M+HCOO]- 419.23400 185.2
[M+CH3COO]- 433.24965 189.9
[M+Na-2H]- 395.21047 193.7
[M]+ 374.23525 179.7
[M]- 374.23635 179.7
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.