CID 2756818

129799-15-1

Structural Information

Molecular Formula

C₁₁H₂₀N₂O₄

SMILES

CC(C)(C)OC(=O)N1CCNCC1C(=O)OC

InChI

InChI=1S/C11H20N2O4/c1-11(2,3)17-10(15)13-6-5-12-7-8(13)9(14)16-4/h8,12H,5-7H2,1-4H3

InChIKey

BRXKHIPPSTYCKO-UHFFFAOYSA-N

Compound name

1-O-tert-butyl 2-O-methyl piperazine-1,2-dicarboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 746
Patents: 244.1423 Da
Monoisotopic Mass: 0.4
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]+	245.14958	157.4
[M+Na]+	267.13152	162.0
[M-H]-	243.13502	156.1
[M+NH4]+	262.17612	171.4
[M+K]+	283.10546	161.6
[M+H-H2O]+	227.13956	150.7
[M+HCOO]-	289.14050	170.6
[M+CH3COO]-	303.15615	188.4
[M+Na-2H]-	265.11697	159.1
[M]+	244.14175	155.6
[M]-	244.14285	155.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe