CID 17915673

1363382-11-9

Structural Information

Molecular Formula

C₉H₁₇NO₄

SMILES

CC(C)(C)OC(=O)NC1(COC1)CO

InChI

InChI=1S/C9H17NO4/c1-8(2,3)14-7(12)10-9(4-11)5-13-6-9/h11H,4-6H2,1-3H3,(H,10,12)

InChIKey

IVFJORRHEURGIF-UHFFFAOYSA-N

Compound name

tert-butyl N-[3-(hydroxymethyl)oxetan-3-yl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 203.11575 Da
Monoisotopic Mass: -0.2
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]+	204.12303	149.2
[M+Na]+	226.10497	152.0
[M+NH4]+	221.14957	152.2
[M+K]+	242.07891	149.8
[M-H]-	202.10847	146.3
[M+Na-2H]-	224.09042	149.8
[M]+	203.11520	147.4
[M]-	203.11630	147.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe