CID 25223587

1010701-31-1

Structural Information

Molecular Formula

C₈H₁₇NO₂

SMILES

CC1(OCC(CO1)CNC)C

InChI

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

InChIKey

CQXAXRLNONSHFG-UHFFFAOYSA-N

Compound name

1-(2,2-dimethyl-1,3-dioxan-5-yl)-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 159.12593 Da
Monoisotopic Mass: 0.2
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]+	160.13321	135.1
[M+Na]+	182.11515	145.5
[M+NH4]+	177.15975	144.9
[M+K]+	198.08909	138.8
[M-H]-	158.11865	139.9
[M+Na-2H]-	180.10060	140.6
[M]+	159.12538	138.0
[M]-	159.12648	138.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe