CID 64106641

2-(pentan-3-yl)oxan-4-amine

Structural Information

Molecular Formula

C₁₀H₂₁NO

SMILES

CCC(CC)C1CC(CCO1)N

InChI

InChI=1S/C10H21NO/c1-3-8(4-2)10-7-9(11)5-6-12-10/h8-10H,3-7,11H2,1-2H3

InChIKey

UHNVXBUVWKYCPX-UHFFFAOYSA-N

Compound name

2-pentan-3-yloxan-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 171.16231 Da
Monoisotopic Mass: 1.8
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]+	172.16959	141.5
[M+Na]+	194.15153	150.9
[M+NH4]+	189.19613	150.0
[M+K]+	210.12547	145.5
[M-H]-	170.15503	145.1
[M+Na-2H]-	192.13698	145.0
[M]+	171.16176	143.6
[M]-	171.16286	143.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.