CID 57143

Brn 2370879

Structural Information

Molecular Formula
C12H26N4O2
SMILES
CCC(CC)NNC(=O)C(=O)NNC(CC)CC
InChI
InChI=1S/C12H26N4O2/c1-5-9(6-2)13-15-11(17)12(18)16-14-10(7-3)8-4/h9-10,13-14H,5-8H2,1-4H3,(H,15,17)(H,16,18)
InChIKey
BLYQHVLDAAOLES-UHFFFAOYSA-N
Compound name
1-N',2-N'-di(pentan-3-yl)ethanedihydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.20557 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.21285 167.4
[M+Na]+ 281.19479 168.4
[M-H]- 257.19829 166.7
[M+NH4]+ 276.23939 182.7
[M+K]+ 297.16873 168.6
[M+H-H2O]+ 241.20283 159.7
[M+HCOO]- 303.20377 190.0
[M+CH3COO]- 317.21942 209.2
[M+Na-2H]- 279.18024 167.0
[M]+ 258.20502 166.1
[M]- 258.20612 166.1
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.