CID 205226

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

Structural Information

Molecular Formula
C13H13N3O2
SMILES
CC(=O)NNC(=O)NC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C13H13N3O2/c1-9(17)15-16-13(18)14-12-8-4-6-10-5-2-3-7-11(10)12/h2-8H,1H3,(H,15,17)(H2,14,16,18)
InChIKey
LZPKAUXWYGSJPF-UHFFFAOYSA-N
Compound name
1-acetamido-3-naphthalen-1-ylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.10077 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.10805 152.0
[M+Na]+ 266.08999 157.6
[M-H]- 242.09349 156.5
[M+NH4]+ 261.13459 169.5
[M+K]+ 282.06393 155.0
[M+H-H2O]+ 226.09803 144.7
[M+HCOO]- 288.09897 177.1
[M+CH3COO]- 302.11462 198.6
[M+Na-2H]- 264.07544 159.5
[M]+ 243.10022 150.3
[M]- 243.10132 150.3
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.