CID 13277851

Brn 5606759

Structural Information

Molecular Formula
C16H15N3O4
SMILES
CC1=CC=C(C=C1)C(=O)NNC(=O)C(=O)NC2=CC=C(C=C2)O
InChI
InChI=1S/C16H15N3O4/c1-10-2-4-11(5-3-10)14(21)18-19-16(23)15(22)17-12-6-8-13(20)9-7-12/h2-9,20H,1H3,(H,17,22)(H,18,21)(H,19,23)
InChIKey
KKGBGLVFZQMLCC-UHFFFAOYSA-N
Compound name
N-(4-hydroxyphenyl)-2-[2-(4-methylbenzoyl)hydrazinyl]-2-oxoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.10626 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.113536 171.3
[M+Na]+ 336.095478 175.6
[M-H]- 312.098984 176.8
[M+NH4]+ 331.140083 183.7
[M+K]+ 352.069418 173.1
[M+H-H2O]+ 296.103520 162.7
[M+HCOO]- 358.104461 194.9
[M+CH3COO]- 372.120111 209.0
[M+Na-2H]- 334.080926 174.1
[M]+ 313.10571142 169.1
[M]- 313.10680858 169.1
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.