CID 86307

112225-87-3

Structural Information

Molecular Formula
C18H20N2O2
SMILES
CC(C)(C)N(C(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C18H20N2O2/c1-18(2,3)20(17(22)15-12-8-5-9-13-15)19-16(21)14-10-6-4-7-11-14/h4-13H,1-3H3,(H,19,21)
InChIKey
NISLLQUWIJASOV-UHFFFAOYSA-N
Compound name
N'-benzoyl-N'-tert-butylbenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

55
References

995
Patents

296.15247 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.15975 170.9
[M+Na]+ 319.14169 174.7
[M-H]- 295.14519 178.4
[M+NH4]+ 314.18629 185.6
[M+K]+ 335.11563 172.8
[M+H-H2O]+ 279.14973 162.5
[M+HCOO]- 341.15067 193.7
[M+CH3COO]- 355.16632 209.1
[M+Na-2H]- 317.12714 175.3
[M]+ 296.15192 170.6
[M]- 296.15302 170.6
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

patents stripe