CID 11160259

130368-98-8

Structural Information

Molecular Formula

C₁₃H₁₅NO₂

SMILES

C=C1CC(C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H15NO2/c1-10-7-12(8-10)14-13(15)16-9-11-5-3-2-4-6-11/h2-6,12H,1,7-9H2,(H,14,15)

InChIKey

HYOKBMVQTGNOCY-UHFFFAOYSA-N

Compound name

benzyl N-(3-methylidenecyclobutyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 54
Patents: 217.11028 Da
Monoisotopic Mass: 2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	218.11756	150.8
[M+Na]+	240.09950	157.4
[M+NH4]+	235.14410	154.6
[M+K]+	256.07344	152.9
[M-H]-	216.10300	151.3
[M+Na-2H]-	238.08495	154.8
[M]+	217.10973	150.4
[M]-	217.11083	150.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe