CID 42609244

301226-25-5

Structural Information

Molecular Formula

C₁₀H₁₇NO₃

SMILES

CC(C)(C)OC(=O)N1CCC2(C1)CO2

InChI

InChI=1S/C10H17NO3/c1-9(2,3)14-8(12)11-5-4-10(6-11)7-13-10/h4-7H2,1-3H3

InChIKey

ZFNBSKYWLUKRRV-UHFFFAOYSA-N

Compound name

tert-butyl 1-oxa-6-azaspiro[2.4]heptane-6-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 71
Patents: 199.12085 Da
Monoisotopic Mass: 0.8
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]+	200.12813	148.2
[M+Na]+	222.11007	157.1
[M-H]-	198.11357	154.0
[M+NH4]+	217.15467	164.2
[M+K]+	238.08401	157.3
[M+H-H2O]+	182.11811	143.3
[M+HCOO]-	244.11905	166.0
[M+CH3COO]-	258.13470	183.8
[M+Na-2H]-	220.09552	154.0
[M]+	199.12030	152.1
[M]-	199.12140	152.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe