CID 6510109

60943-75-1

Structural Information

Molecular Formula
C15H20N2O2
SMILES
CCC/C(=N/NC(=O)C1CCCO1)/C2=CC=CC=C2
InChI
InChI=1S/C15H20N2O2/c1-2-7-13(12-8-4-3-5-9-12)16-17-15(18)14-10-6-11-19-14/h3-5,8-9,14H,2,6-7,10-11H2,1H3,(H,17,18)/b16-13-
InChIKey
YJHQBFSUQXBLHC-SSZFMOIBSA-N
Compound name
N-[(Z)-1-phenylbutylideneamino]oxolane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.15247 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.15975 163.3
[M+Na]+ 283.14169 166.0
[M-H]- 259.14519 170.7
[M+NH4]+ 278.18629 179.7
[M+K]+ 299.11563 165.0
[M+H-H2O]+ 243.14973 155.2
[M+HCOO]- 305.15067 186.6
[M+CH3COO]- 319.16632 200.8
[M+Na-2H]- 281.12714 165.9
[M]+ 260.15192 161.6
[M]- 260.15302 161.6
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.