CID 9570409

4'-phenoxy-2-(1-pyrrolidinylimino)acetophenone

Structural Information

Molecular Formula
C18H18N2O2
SMILES
C1CCN(C1)/N=C/C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3
InChI
InChI=1S/C18H18N2O2/c21-18(14-19-20-12-4-5-13-20)15-8-10-17(11-9-15)22-16-6-2-1-3-7-16/h1-3,6-11,14H,4-5,12-13H2/b19-14+
InChIKey
KCYDSCVBZLDRSV-XMHGGMMESA-N
Compound name
(2E)-1-(4-phenoxyphenyl)-2-pyrrolidin-1-yliminoethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.13684 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.14412 170.6
[M+Na]+ 317.12606 183.0
[M+NH4]+ 312.17066 178.5
[M+K]+ 333.10000 176.8
[M-H]- 293.12956 176.3
[M+Na-2H]- 315.11151 179.8
[M]+ 294.13629 173.8
[M]- 294.13739 173.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.