CID 6445153

23804-85-5

Structural Information

Molecular Formula
C16H20N2O2
SMILES
C1CN(CCC12CNC(=O)O2)/C=C/CC3=CC=CC=C3
InChI
InChI=1S/C16H20N2O2/c19-15-17-13-16(20-15)8-11-18(12-9-16)10-4-7-14-5-2-1-3-6-14/h1-6,10H,7-9,11-13H2,(H,17,19)/b10-4+
InChIKey
ZFMRMZYRWDKVSB-ONNFQVAWSA-N
Compound name
8-[(E)-3-phenylprop-1-enyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.15247 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.159746 165.4
[M+Na]+ 295.141688 170.1
[M-H]- 271.145194 169.5
[M+NH4]+ 290.186293 180.2
[M+K]+ 311.115628 166.0
[M+H-H2O]+ 255.149730 156.4
[M+HCOO]- 317.150671 179.8
[M+CH3COO]- 331.166321 174.9
[M+Na-2H]- 293.127136 167.9
[M]+ 272.15192142 158.7
[M]- 272.15301858 158.7
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.