CID 78973179

(2r)-2-amino-n-[2-(piperidin-1-yl)ethyl]propanamide dihydrochloride

Structural Information

Molecular Formula

C₁₀H₂₁N₃O

SMILES

C[C@H](C(=O)NCCN1CCCCC1)N

InChI

InChI=1S/C10H21N3O/c1-9(11)10(14)12-5-8-13-6-3-2-4-7-13/h9H,2-8,11H2,1H3,(H,12,14)/t9-/m1/s1

InChIKey

ZQGMBDFNUBPXHP-SECBINFHSA-N

Compound name

(2R)-2-amino-N-(2-piperidin-1-ylethyl)propanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 199.16846 Da
Monoisotopic Mass: -0.1
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]+	200.175736	149.1
[M+Na]+	222.157678	151.0
[M-H]-	198.161184	149.3
[M+NH4]+	217.202283	165.6
[M+K]+	238.131618	149.9
[M+H-H2O]+	182.165720	141.5
[M+HCOO]-	244.166661	167.5
[M+CH3COO]-	258.182311	189.5
[M+Na-2H]-	220.143126	150.8
[M]+	199.16791142	142.4
[M]-	199.16900858	142.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe