CID 5376969

Piperonal, phenylhydrazone

Structural Information

Molecular Formula
C14H12N2O2
SMILES
C1OC2=C(O1)C=C(C=C2)/C=N\NC3=CC=CC=C3
InChI
InChI=1S/C14H12N2O2/c1-2-4-12(5-3-1)16-15-9-11-6-7-13-14(8-11)18-10-17-13/h1-9,16H,10H2/b15-9-
InChIKey
BXPJESDAKFUKSF-DHDCSXOGSA-N
Compound name
N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.08987 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.09715 150.5
[M+Na]+ 263.07909 157.7
[M-H]- 239.08259 160.7
[M+NH4]+ 258.12369 168.0
[M+K]+ 279.05303 156.5
[M+H-H2O]+ 223.08713 143.1
[M+HCOO]- 285.08807 176.4
[M+CH3COO]- 299.10372 164.1
[M+Na-2H]- 261.06454 160.1
[M]+ 240.08932 151.9
[M]- 240.09042 151.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.