CID 3077252

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

Structural Information

Molecular Formula
C22H23FN2O2
SMILES
C=C1C2(CCN(CC2)CCC3=CC=C(C=C3)F)OC(=O)N1C4=CC=CC=C4
InChI
InChI=1S/C22H23FN2O2/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
QXUZAQAGGCNXBW-UHFFFAOYSA-N
Compound name
8-[2-(4-fluorophenyl)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

7
Patents

366.17435 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.18163 189.7
[M+Na]+ 389.16357 196.3
[M-H]- 365.16707 197.4
[M+NH4]+ 384.20817 201.4
[M+K]+ 405.13751 190.5
[M+H-H2O]+ 349.17161 177.9
[M+HCOO]- 411.17255 203.6
[M+CH3COO]- 425.18820 198.5
[M+Na-2H]- 387.14902 188.5
[M]+ 366.17380 184.4
[M]- 366.17490 184.4
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