CID 16775041

[(furan-2-yl)methyl](3-methylbutyl)amine hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₇NO

SMILES

CC(C)CCNCC1=CC=CO1

InChI

InChI=1S/C10H17NO/c1-9(2)5-6-11-8-10-4-3-7-12-10/h3-4,7,9,11H,5-6,8H2,1-2H3

InChIKey

SALRNWVFVBHCQW-UHFFFAOYSA-N

Compound name

N-(furan-2-ylmethyl)-3-methylbutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 167.13101 Da
Monoisotopic Mass: 2.1
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]+	168.13829	139.0
[M+Na]+	190.12023	149.0
[M+NH4]+	185.16483	147.4
[M+K]+	206.09417	144.9
[M-H]-	166.12373	142.2
[M+Na-2H]-	188.10568	143.9
[M]+	167.13046	141.1
[M]-	167.13156	141.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe