CID 154747214

2228944-34-9

Structural Information

Molecular Formula

C₁₁H₁₇NO₃

SMILES

CC(C)(C)OC(=O)NC1(CCOC1)C#C

InChI

InChI=1S/C11H17NO3/c1-5-11(6-7-14-8-11)12-9(13)15-10(2,3)4/h1H,6-8H2,2-4H3,(H,12,13)

InChIKey

SIWFTHWAWUFOOG-UHFFFAOYSA-N

Compound name

tert-butyl N-(3-ethynyloxolan-3-yl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 211.12085 Da
Monoisotopic Mass: 0.9
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]+	212.128126	149.7
[M+Na]+	234.110068	157.9
[M-H]-	210.113574	152.0
[M+NH4]+	229.154673	168.2
[M+K]+	250.084008	156.2
[M+H-H2O]+	194.118110	139.1
[M+HCOO]-	256.119051	164.5
[M+CH3COO]-	270.134701	192.9
[M+Na-2H]-	232.095516	154.0
[M]+	211.12030142	144.6
[M]-	211.12139858	144.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe