CID 59003263

875551-76-1

Structural Information

Molecular Formula

C₁₀H₂₁N₃O₂

SMILES

CC(C)(C)OC(=O)NCC1CNCCN1

InChI

InChI=1S/C10H21N3O2/c1-10(2,3)15-9(14)13-7-8-6-11-4-5-12-8/h8,11-12H,4-7H2,1-3H3,(H,13,14)

InChIKey

XWVBNGQHXQOIBF-UHFFFAOYSA-N

Compound name

tert-butyl N-(piperazin-2-ylmethyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 215.16338 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]+	216.17066	151.7
[M+Na]+	238.15260	158.3
[M+NH4]+	233.19720	156.9
[M+K]+	254.12654	155.1
[M-H]-	214.15610	149.8
[M+Na-2H]-	236.13805	153.6
[M]+	215.16283	151.5
[M]-	215.16393	151.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe