CID 114364

N-(3,4,5-triallyloxybenzoyl)-piperazine hydrochloride

Structural Information

Molecular Formula
C20H26N2O4
SMILES
C=CCOC1=CC(=CC(=C1OCC=C)OCC=C)C(=O)N2CCNCC2
InChI
InChI=1S/C20H26N2O4/c1-4-11-24-17-14-16(20(23)22-9-7-21-8-10-22)15-18(25-12-5-2)19(17)26-13-6-3/h4-6,14-15,21H,1-3,7-13H2
InChIKey
VVUCKONKPHXDCQ-UHFFFAOYSA-N
Compound name
piperazin-1-yl-[3,4,5-tris(prop-2-enoxy)phenyl]methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.18927 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.19655 188.7
[M+Na]+ 381.17849 198.6
[M+NH4]+ 376.22309 192.5
[M+K]+ 397.15243 192.1
[M-H]- 357.18199 188.7
[M+Na-2H]- 379.16394 191.3
[M]+ 358.18872 189.6
[M]- 358.18982 189.6
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.