CID 9570984

103245-63-2

Structural Information

Molecular Formula
C18H17N5O3
SMILES
C1=CC2=C(C=CC(=C2)OC(=O)C3=CC=C(O3)CN=CNN)C=C1/C=N/N
InChI
InChI=1S/C18H17N5O3/c19-22-9-12-1-2-14-8-15(4-3-13(14)7-12)26-18(24)17-6-5-16(25-17)10-21-11-23-20/h1-9,11H,10,19-20H2,(H,21,23)/b22-9+
InChIKey
RTZDLAFEDRGTNI-LSFURLLWSA-N
Compound name
[6-[(E)-hydrazinylidenemethyl]naphthalen-2-yl] 5-[(hydrazinylmethylideneamino)methyl]furan-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.13315 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.140426 179.3
[M+Na]+ 374.122368 186.0
[M-H]- 350.125874 189.9
[M+NH4]+ 369.166973 192.9
[M+K]+ 390.096308 183.5
[M+H-H2O]+ 334.130410 169.5
[M+HCOO]- 396.131351 210.1
[M+CH3COO]- 410.147001 227.4
[M+Na-2H]- 372.107816 185.7
[M]+ 351.13260142 182.1
[M]- 351.13369858 182.1
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.