CID 15197650

1312935-03-7

Structural Information

Molecular Formula

C₁₀H₂₀N₄O₂

SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=N)N

InChI

InChI=1S/C10H20N4O2/c1-10(2,3)16-9(15)14-6-4-13(5-7-14)8(11)12/h4-7H2,1-3H3,(H3,11,12)

InChIKey

MJNAHJKRZWPBSX-UHFFFAOYSA-N

Compound name

tert-butyl 4-carbamimidoylpiperazine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 94
Patents: 228.15863 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]+	229.16591	153.3
[M+Na]+	251.14785	159.5
[M+NH4]+	246.19245	158.1
[M+K]+	267.12179	157.4
[M-H]-	227.15135	152.1
[M+Na-2H]-	249.13330	155.0
[M]+	228.15808	153.2
[M]-	228.15918	153.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe