CID 3077248

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

Structural Information

Molecular Formula
C22H23ClN2O2
SMILES
C=C1C2(CCN(CC2)CCC3=CC=C(C=C3)Cl)OC(=O)N1C4=CC=CC=C4
InChI
InChI=1S/C22H23ClN2O2/c1-17-22(27-21(26)25(17)20-5-3-2-4-6-20)12-15-24(16-13-22)14-11-18-7-9-19(23)10-8-18/h2-10H,1,11-16H2
InChIKey
HZZXPCOTKUDMCZ-UHFFFAOYSA-N
Compound name
8-[2-(4-chlorophenyl)ethyl]-4-methylidene-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

382.1448 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.15208 194.2
[M+Na]+ 405.13402 201.3
[M-H]- 381.13752 202.9
[M+NH4]+ 400.17862 206.1
[M+K]+ 421.10796 194.6
[M+H-H2O]+ 365.14206 183.4
[M+HCOO]- 427.14300 204.4
[M+CH3COO]- 441.15865 203.0
[M+Na-2H]- 403.11947 192.9
[M]+ 382.14425 192.0
[M]- 382.14535 192.0
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