CID 6473965

Di-2-buten hydr

Structural Information

Molecular Formula
C8H12N2O2
SMILES
C/C=C/C(=O)NNC(=O)/C=C/C
InChI
InChI=1S/C8H12N2O2/c1-3-5-7(11)9-10-8(12)6-4-2/h3-6H,1-2H3,(H,9,11)(H,10,12)/b5-3+,6-4+
InChIKey
GUHQRXLRGWOGTE-GGWOSOGESA-N
Compound name
(E)-N'-[(E)-but-2-enoyl]but-2-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

168.08987 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.09715 138.4
[M+Na]+ 191.07909 144.2
[M-H]- 167.08259 138.7
[M+NH4]+ 186.12369 158.4
[M+K]+ 207.05303 142.8
[M+H-H2O]+ 151.08713 132.9
[M+HCOO]- 213.08807 163.0
[M+CH3COO]- 227.10372 181.6
[M+Na-2H]- 189.06454 142.3
[M]+ 168.08932 137.2
[M]- 168.09042 137.2
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