CID 27391

Benzoic acid, 3,4,5-trimethoxy-, 2-isopropylhydrazide

Structural Information

Molecular Formula
C13H20N2O4
SMILES
CC(C)NNC(=O)C1=CC(=C(C(=C1)OC)OC)OC
InChI
InChI=1S/C13H20N2O4/c1-8(2)14-15-13(16)9-6-10(17-3)12(19-5)11(7-9)18-4/h6-8,14H,1-5H3,(H,15,16)
InChIKey
ZFTFLJTVUCFSRS-UHFFFAOYSA-N
Compound name
3,4,5-trimethoxy-N'-propan-2-ylbenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.1423 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.14958 161.2
[M+Na]+ 291.13152 167.4
[M-H]- 267.13502 165.1
[M+NH4]+ 286.17612 177.5
[M+K]+ 307.10546 167.3
[M+H-H2O]+ 251.13956 154.0
[M+HCOO]- 313.14050 185.5
[M+CH3COO]- 327.15615 205.5
[M+Na-2H]- 289.11697 163.3
[M]+ 268.14175 165.9
[M]- 268.14285 165.9
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

patents stripe