CID 155973879

2648869-97-8

Structural Information

Molecular Formula

C₁₃H₂₅N₃O₃

SMILES

CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1N2CCNCC2

InChI

InChI=1S/C13H25N3O3/c1-13(2,3)19-12(17)15-10-8-18-9-11(10)16-6-4-14-5-7-16/h10-11,14H,4-9H2,1-3H3,(H,15,17)/t10-,11-/m1/s1

InChIKey

ZFXRZDKYOHRVDO-GHMZBOCLSA-N

Compound name

tert-butyl N-[(3S,4S)-4-piperazin-1-yloxolan-3-yl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 271.1896 Da
Monoisotopic Mass: 0.1
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]+	272.196876	166.6
[M+Na]+	294.178818	168.5
[M-H]-	270.182324	168.4
[M+NH4]+	289.223423	179.2
[M+K]+	310.152758	167.9
[M+H-H2O]+	254.186860	158.7
[M+HCOO]-	316.187801	179.1
[M+CH3COO]-	330.203451	194.5
[M+Na-2H]-	292.164266	167.6
[M]+	271.18905142	160.6
[M]-	271.19014858	160.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.