CID 11286907

107017-73-2

Structural Information

Molecular Formula

C₉H₁₇NO₃

SMILES

CC(C)(C)OC(=O)NC1(CC1)CO

InChI

InChI=1S/C9H17NO3/c1-8(2,3)13-7(12)10-9(6-11)4-5-9/h11H,4-6H2,1-3H3,(H,10,12)

InChIKey

HFMAZNJKNNRONT-UHFFFAOYSA-N

Compound name

tert-butyl N-[1-(hydroxymethyl)cyclopropyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 647
Patents: 187.12085 Da
Monoisotopic Mass: 0.6
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	144.4
[M+Na]+	210.11007	153.7
[M+NH4]+	205.15467	152.7
[M+K]+	226.08401	150.1
[M-H]-	186.11357	150.6
[M+Na-2H]-	208.09552	151.4
[M]+	187.12030	148.5
[M]-	187.12140	148.5

Literature stripe

literature stripe

Patent stripe

patents stripe