CID 86678002

105090-82-2

Structural Information

Molecular Formula

C₁₁H₂₄N₂O₂

SMILES

CC(C)(C)OC(=O)NCCCC(C)(C)N

InChI

InChI=1S/C11H24N2O2/c1-10(2,3)15-9(14)13-8-6-7-11(4,5)12/h6-8,12H2,1-5H3,(H,13,14)

InChIKey

OLMOMQPMUBCXAM-UHFFFAOYSA-N

Compound name

tert-butyl N-(4-amino-4-methylpentyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 216.18378 Da
Monoisotopic Mass: 1.3
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]+	217.19106	154.6
[M+Na]+	239.17300	159.1
[M-H]-	215.17650	154.1
[M+NH4]+	234.21760	172.8
[M+K]+	255.14694	158.9
[M+H-H2O]+	199.18104	149.6
[M+HCOO]-	261.18198	174.8
[M+CH3COO]-	275.19763	194.1
[M+Na-2H]-	237.15845	158.8
[M]+	216.18323	155.4
[M]-	216.18433	155.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe