CID 10943251

287945-66-8

Structural Information

Molecular Formula

C₅H₁₂N₂O

SMILES

C1[C@H]([C@H](CC1O)N)N

InChI

InChI=1S/C5H12N2O/c6-4-1-3(8)2-5(4)7/h3-5,8H,1-2,6-7H2/t3?,4-,5+

InChIKey

FMBIQZAABNLKQQ-NVGWPGHNSA-N

Compound name

(3R,4S)-3,4-diaminocyclopentan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 116.09496 Da
Monoisotopic Mass: -1.7
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]+	117.10224	122.3
[M+Na]+	139.08418	129.6
[M+NH4]+	134.12878	130.4
[M+K]+	155.05812	127.7
[M-H]-	115.08768	123.6
[M+Na-2H]-	137.06963	125.3
[M]+	116.09441	123.2
[M]-	116.09551	123.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe