CID 155821042

2490405-96-2

Structural Information

Molecular Formula

C₁₀H₁₇NO₃

SMILES

CC(C)(C)OC(=O)NOC1CCC=C1

InChI

InChI=1S/C10H17NO3/c1-10(2,3)13-9(12)11-14-8-6-4-5-7-8/h4,6,8H,5,7H2,1-3H3,(H,11,12)

InChIKey

DRVCOSHJUQYAOQ-UHFFFAOYSA-N

Compound name

tert-butyl N-cyclopent-2-en-1-yloxycarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 199.12085 Da
Monoisotopic Mass: 2.1
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]+	200.128126	145.8
[M+Na]+	222.110068	151.2
[M-H]-	198.113574	149.1
[M+NH4]+	217.154673	166.5
[M+K]+	238.084008	151.3
[M+H-H2O]+	182.118110	140.3
[M+HCOO]-	244.119051	168.6
[M+CH3COO]-	258.134701	183.9
[M+Na-2H]-	220.095516	150.1
[M]+	199.12030142	146.7
[M]-	199.12139858	146.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.