CID 1830221

3-(1h-benzotriazol-1-yl)-n'-[(1e,2e)-3-phenylprop-2-en-1-ylidene]propanehydrazide

Structural Information

Molecular Formula
C18H17N5O
SMILES
C1=CC=C(C=C1)/C=C/C=N/NC(=O)CCN2C3=CC=CC=C3N=N2
InChI
InChI=1S/C18H17N5O/c24-18(21-19-13-6-9-15-7-2-1-3-8-15)12-14-23-17-11-5-4-10-16(17)20-22-23/h1-11,13H,12,14H2,(H,21,24)/b9-6+,19-13+
InChIKey
SKIUKAARLLGZPZ-MHTHSFAKSA-N
Compound name
3-(benzotriazol-1-yl)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.1433 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.15058 174.7
[M+Na]+ 342.13252 187.6
[M+NH4]+ 337.17712 180.9
[M+K]+ 358.10646 181.2
[M-H]- 318.13602 178.1
[M+Na-2H]- 340.11797 183.1
[M]+ 319.14275 177.2
[M]- 319.14385 177.2
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.