CID 118450

Propylamine, n-methyl-n,1,1-triethyl-, hydrobromide

Structural Information

Molecular Formula

C₁₀H₂₃N

SMILES

CCC(CC)(CC)N(C)CC

InChI

InChI=1S/C10H23N/c1-6-10(7-2,8-3)11(5)9-4/h6-9H2,1-5H3

InChIKey

XDSSZOHFCHFKLF-UHFFFAOYSA-N

Compound name

N,3-diethyl-N-methylpentan-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 157.18304 Da
Monoisotopic Mass: 3.2
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]+	158.19032	140.7
[M+Na]+	180.17226	146.1
[M-H]-	156.17576	142.1
[M+NH4]+	175.21686	162.5
[M+K]+	196.14620	146.6
[M+H-H2O]+	140.18030	135.8
[M+HCOO]-	202.18124	163.2
[M+CH3COO]-	216.19689	188.1
[M+Na-2H]-	178.15771	145.8
[M]+	157.18249	143.5
[M]-	157.18359	143.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe