CID 45792518

(cyclopropylmethyl)(2,2-dimethoxyethyl)amine

Structural Information

Molecular Formula

C₈H₁₇NO₂

SMILES

COC(CNCC1CC1)OC

InChI

InChI=1S/C8H17NO2/c1-10-8(11-2)6-9-5-7-3-4-7/h7-9H,3-6H2,1-2H3

InChIKey

NHGWIPBDFWJQFG-UHFFFAOYSA-N

Compound name

N-(cyclopropylmethyl)-2,2-dimethoxyethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 159.12593 Da
Monoisotopic Mass: 0.4
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]+	160.13321	134.4
[M+Na]+	182.11515	144.6
[M+NH4]+	177.15975	142.7
[M+K]+	198.08909	141.2
[M-H]-	158.11865	142.2
[M+Na-2H]-	180.10060	141.3
[M]+	159.12538	138.9
[M]-	159.12648	138.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe