CID 21882540

1393441-75-2

Structural Information

Molecular Formula

C₁₂H₂₄N₂O₂

SMILES

CC(C)(C)OC(=O)NCC1CCC(CC1)N

InChI

InChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)14-8-9-4-6-10(13)7-5-9/h9-10H,4-8,13H2,1-3H3,(H,14,15)

InChIKey

HMMYZMWDTDJTRR-UHFFFAOYSA-N

Compound name

tert-butyl N-[(4-aminocyclohexyl)methyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 284
Patents: 228.18378 Da
Monoisotopic Mass: 1.5
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]+	229.19106	155.4
[M+Na]+	251.17300	162.0
[M+NH4]+	246.21760	162.0
[M+K]+	267.14694	158.0
[M-H]-	227.17650	156.3
[M+Na-2H]-	249.15845	157.9
[M]+	228.18323	156.1
[M]-	228.18433	156.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe