CID 6473946

1phco-2-butenoy

Structural Information

Molecular Formula
C11H12N2O2
SMILES
C/C=C/C(=O)NNC(=O)C1=CC=CC=C1
InChI
InChI=1S/C11H12N2O2/c1-2-6-10(14)12-13-11(15)9-7-4-3-5-8-9/h2-8H,1H3,(H,12,14)(H,13,15)/b6-2+
InChIKey
RBPRVZIPDXGYOP-QHHAFSJGSA-N
Compound name
N'-[(E)-but-2-enoyl]benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.08987 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.09715 145.6
[M+Na]+ 227.07909 151.0
[M-H]- 203.08259 149.0
[M+NH4]+ 222.12369 163.8
[M+K]+ 243.05303 148.8
[M+H-H2O]+ 187.08713 138.8
[M+HCOO]- 249.08807 170.7
[M+CH3COO]- 263.10372 187.6
[M+Na-2H]- 225.06454 150.8
[M]+ 204.08932 143.9
[M]- 204.09042 143.9
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.