CID 24720963

1008773-79-2

Structural Information

Molecular Formula

C₁₀H₁₇NO₄

SMILES

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

InChI

InChI=1S/C10H17NO4/c1-10(2,3)15-9(14)11-7-4-6(5-7)8(12)13/h6-7H,4-5H2,1-3H3,(H,11,14)(H,12,13)

InChIKey

KLCYDBAYYYVNFM-UHFFFAOYSA-N

Compound name

3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutane-1-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 399
Patents: 215.11575 Da
Monoisotopic Mass: 1.0
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]+	216.123026	150.9
[M+Na]+	238.104968	154.1
[M-H]-	214.108474	152.7
[M+NH4]+	233.149573	161.8
[M+K]+	254.078908	157.4
[M+H-H2O]+	198.113010	140.0
[M+HCOO]-	260.113951	168.6
[M+CH3COO]-	274.129601	190.2
[M+Na-2H]-	236.090416	152.5
[M]+	215.11520142	159.0
[M]-	215.11629858	159.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe