CID 10705519

191110-53-9

Structural Information

Molecular Formula

C₁₁H₁₉NO₅

SMILES

CC(C)(C)OC(=O)NC1(CC(C1)O)C(=O)OC

InChI

InChI=1S/C11H19NO5/c1-10(2,3)17-9(15)12-11(8(14)16-4)5-7(13)6-11/h7,13H,5-6H2,1-4H3,(H,12,15)

InChIKey

COSQCBGGUXHPQO-UHFFFAOYSA-N

Compound name

methyl 3-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutane-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 245.12633 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]+	246.133606	158.4
[M+Na]+	268.115548	161.9
[M-H]-	244.119054	160.3
[M+NH4]+	263.160153	170.2
[M+K]+	284.089488	165.8
[M+H-H2O]+	228.123590	148.9
[M+HCOO]-	290.124531	175.9
[M+CH3COO]-	304.140181	194.2
[M+Na-2H]-	266.100996	161.0
[M]+	245.12578142	168.7
[M]-	245.12687858	168.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe