CID 21643904

132740-55-7

Structural Information

Molecular Formula

C₉H₂₀N₂O

SMILES

CC(C)N1CCC(CC1)(CN)O

InChI

InChI=1S/C9H20N2O/c1-8(2)11-5-3-9(12,7-10)4-6-11/h8,12H,3-7,10H2,1-2H3

InChIKey

DAMMODNJHFWQSC-UHFFFAOYSA-N

Compound name

4-(aminomethyl)-1-propan-2-ylpiperidin-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 172.15756 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]+	173.16484	140.8
[M+Na]+	195.14678	149.4
[M+NH4]+	190.19138	149.8
[M+K]+	211.12072	142.9
[M-H]-	171.15028	141.7
[M+Na-2H]-	193.13223	145.6
[M]+	172.15701	142.1
[M]-	172.15811	142.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe