CID 57341

Brn 0689748

Structural Information

Molecular Formula
C16H18N4O2
SMILES
CC1=CC=CC=C1NNC(=O)C(=O)NNC2=CC=CC=C2C
InChI
InChI=1S/C16H18N4O2/c1-11-7-3-5-9-13(11)17-19-15(21)16(22)20-18-14-10-6-4-8-12(14)2/h3-10,17-18H,1-2H3,(H,19,21)(H,20,22)
InChIKey
HHXVQXRNVKSRRO-UHFFFAOYSA-N
Compound name
1-N',2-N'-bis(2-methylphenyl)ethanedihydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

18
Patents

298.14297 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.150246 168.9
[M+Na]+ 321.132188 173.0
[M-H]- 297.135694 175.6
[M+NH4]+ 316.176793 182.5
[M+K]+ 337.106128 170.0
[M+H-H2O]+ 281.140230 159.9
[M+HCOO]- 343.141171 195.4
[M+CH3COO]- 357.156821 213.2
[M+Na-2H]- 319.117636 173.7
[M]+ 298.14242142 166.6
[M]- 298.14351858 166.6
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