CID 22594430

389890-43-1

Structural Information

Molecular Formula

C₉H₁₇NO₃

SMILES

CC(C)(C)OC(=O)NC1CC(C1)O

InChI

InChI=1S/C9H17NO3/c1-9(2,3)13-8(12)10-6-4-7(11)5-6/h6-7,11H,4-5H2,1-3H3,(H,10,12)

InChIKey

WSUMHFNEPOYLJM-UHFFFAOYSA-N

Compound name

tert-butyl N-(3-hydroxycyclobutyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1066
Patents: 187.12085 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]+	188.12813	146.6
[M+Na]+	210.11007	149.7
[M+NH4]+	205.15467	148.9
[M+K]+	226.08401	148.5
[M-H]-	186.11357	143.0
[M+Na-2H]-	208.09552	146.2
[M]+	187.12030	144.4
[M]-	187.12140	144.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe