CID 379571

Semicarbazide, 1-formyl-4-(1-naphthyl)-

Structural Information

Molecular Formula
C12H11N3O2
SMILES
C1=CC=C2C(=C1)C=CC=C2NC(=O)NNC=O
InChI
InChI=1S/C12H11N3O2/c16-8-13-15-12(17)14-11-7-3-5-9-4-1-2-6-10(9)11/h1-8H,(H,13,16)(H2,14,15,17)
InChIKey
AILGPMRVRXMDPB-UHFFFAOYSA-N
Compound name
N-(naphthalen-1-ylcarbamoylamino)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.08513 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.092406 145.8
[M+Na]+ 252.074348 152.0
[M-H]- 228.077854 150.3
[M+NH4]+ 247.118953 163.7
[M+K]+ 268.048288 149.0
[M+H-H2O]+ 212.082390 138.6
[M+HCOO]- 274.083331 172.2
[M+CH3COO]- 288.098981 196.0
[M+Na-2H]- 250.059796 155.2
[M]+ 229.08458142 144.5
[M]- 229.08567858 144.5
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.