CID 3077245

1-oxa-3,8-diazaspiro(4.5)decan-2-one, 4-methylene-3-phenyl-8-(2-phenylethyl)-

Structural Information

Molecular Formula
C22H24N2O2
SMILES
C=C1C2(CCN(CC2)CCC3=CC=CC=C3)OC(=O)N1C4=CC=CC=C4
InChI
InChI=1S/C22H24N2O2/c1-18-22(26-21(25)24(18)20-10-6-3-7-11-20)13-16-23(17-14-22)15-12-19-8-4-2-5-9-19/h2-11H,1,12-17H2
InChIKey
AEYHMYIOVQXIRF-UHFFFAOYSA-N
Compound name
4-methylidene-3-phenyl-8-(2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

348.18378 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.19106 186.1
[M+Na]+ 371.17300 191.7
[M-H]- 347.17650 194.9
[M+NH4]+ 366.21760 198.4
[M+K]+ 387.14694 186.4
[M+H-H2O]+ 331.18104 175.0
[M+HCOO]- 393.18198 201.1
[M+CH3COO]- 407.19763 195.2
[M+Na-2H]- 369.15845 186.2
[M]+ 348.18323 181.4
[M]- 348.18433 181.4
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

patents stripe