CID 121057

Propanedinitrile, ((2-methoxyphenyl)hydrazono)-

Structural Information

Molecular Formula
C10H8N4O
SMILES
COC1=CC=CC=C1NN=C(C#N)C#N
InChI
InChI=1S/C10H8N4O/c1-15-10-5-3-2-4-9(10)14-13-8(6-11)7-12/h2-5,14H,1H3
InChIKey
JCUXZOWDFITKAT-UHFFFAOYSA-N
Compound name
2-[(2-methoxyphenyl)hydrazinylidene]propanedinitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.06981 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.07709 157.9
[M+Na]+ 223.05903 166.4
[M-H]- 199.06253 161.7
[M+NH4]+ 218.10363 170.1
[M+K]+ 239.03297 164.1
[M+H-H2O]+ 183.06707 141.9
[M+HCOO]- 245.06801 172.4
[M+CH3COO]- 259.08366 221.0
[M+Na-2H]- 221.04448 160.4
[M]+ 200.06926 149.9
[M]- 200.07036 149.9
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

patents stripe