CID 9570382

24342-47-0

Structural Information

Molecular Formula
C19H21N3O
SMILES
CN1CCN(CC1)/N=C/C(=O)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H21N3O/c1-21-11-13-22(14-12-21)20-15-19(23)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3/b20-15+
InChIKey
VIVBUFPCVJRHEX-HMMYKYKNSA-N
Compound name
(2E)-2-(4-methylpiperazin-1-yl)imino-1-(4-phenylphenyl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.16846 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.175736 174.5
[M+Na]+ 330.157678 178.8
[M-H]- 306.161184 181.5
[M+NH4]+ 325.202283 185.9
[M+K]+ 346.131618 173.7
[M+H-H2O]+ 290.165720 163.0
[M+HCOO]- 352.166661 193.5
[M+CH3COO]- 366.182311 209.6
[M+Na-2H]- 328.143126 177.7
[M]+ 307.16791142 170.4
[M]- 307.16900858 170.4
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

No patent data available for this compound.