CID 58773809

2168025-77-0

Structural Information

Molecular Formula

C₁₀H₁₉NO₃

SMILES

CC1(CC(C1)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C10H19NO3/c1-9(2,3)14-8(13)11-10(4)5-7(12)6-10/h7,12H,5-6H2,1-4H3,(H,11,13)

InChIKey

SWADYQXRAYVLDH-UHFFFAOYSA-N

Compound name

tert-butyl N-(3-hydroxy-1-methylcyclobutyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 24
Patents: 201.13649 Da
Monoisotopic Mass: 1.1
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]+	202.143766	149.4
[M+Na]+	224.125708	153.8
[M-H]-	200.129214	151.6
[M+NH4]+	219.170313	163.3
[M+K]+	240.099648	156.6
[M+H-H2O]+	184.133750	140.4
[M+HCOO]-	246.134691	167.7
[M+CH3COO]-	260.150341	187.7
[M+Na-2H]-	222.111156	153.4
[M]+	201.13594142	157.9
[M]-	201.13703858	157.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe