CID 9570514

Hydrazinium, dimethyl(((5-nitrofurfurylidene)hydrazino)carbonylmethyl)-, bromide

Structural Information

Molecular Formula
C9H14N5O4
SMILES
C[N+](C)(CC(=O)N/N=C/C1=CC=C(O1)[N+](=O)[O-])N
InChI
InChI=1S/C9H13N5O4/c1-14(2,10)6-8(15)12-11-5-7-3-4-9(18-7)13(16)17/h3-5H,6,10H2,1-2H3/p+1/b11-5+
InChIKey
HNYJGZODZVKTBB-VZUCSPMQSA-O
Compound name
amino-dimethyl-[2-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-2-oxoethyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.10458 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.11186 149.7
[M+Na]+ 279.09380 153.9
[M-H]- 255.09730 156.3
[M+NH4]+ 274.13840 165.4
[M+K]+ 295.06774 145.4
[M+H-H2O]+ 239.10184 149.5
[M+HCOO]- 301.10278 178.5
[M+CH3COO]- 315.11843 192.9
[M+Na-2H]- 277.07925 161.8
[M]+ 256.10403 147.4
[M]- 256.10513 147.4
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.