CID 58520785

1154759-69-9

Structural Information

Molecular Formula

C₁₀H₁₇NO₃

SMILES

CC(C)(C)OC(=O)NC1CC2(C1)CO2

InChI

InChI=1S/C10H17NO3/c1-9(2,3)14-8(12)11-7-4-10(5-7)6-13-10/h7H,4-6H2,1-3H3,(H,11,12)

InChIKey

GWOICXWGUZSVLV-UHFFFAOYSA-N

Compound name

tert-butyl N-(1-oxaspiro[2.3]hexan-5-yl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 118
Patents: 199.12085 Da
Monoisotopic Mass: 1.0
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]+	200.12813	149.3
[M+Na]+	222.11007	155.2
[M+NH4]+	217.15467	154.6
[M+K]+	238.08401	153.2
[M-H]-	198.11357	155.4
[M+Na-2H]-	220.09552	153.9
[M]+	199.12030	151.9
[M]-	199.12140	151.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe