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]+ 230.09241 145.8
[M+Na]+ 252.07435 152.0
[M-H]- 228.07785 150.3
[M+NH4]+ 247.11895 163.7
[M+K]+ 268.04829 149.0
[M+H-H2O]+ 212.08239 138.6
[M+HCOO]- 274.08333 172.2
[M+CH3COO]- 288.09898 196.0
[M+Na-2H]- 250.05980 155.2
[M]+ 229.08458 144.5
[M]- 229.08568 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.