CID 10678208

38118-79-5

Structural Information

Molecular Formula

C₇H₁₅N

SMILES

C[C@@H](C1CCCC1)N

InChI

InChI=1S/C7H15N/c1-6(8)7-4-2-3-5-7/h6-7H,2-5,8H2,1H3/t6-/m0/s1

InChIKey

NLHIUUMEKSNMLS-LURJTMIESA-N

Compound name

(1S)-1-cyclopentylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 244
Patents: 113.12045 Da
Monoisotopic Mass: 1.5
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]+	114.127726	126.6
[M+Na]+	136.109668	131.4
[M-H]-	112.113174	129.0
[M+NH4]+	131.154273	150.2
[M+K]+	152.083608	130.8
[M+H-H2O]+	96.117710	121.2
[M+HCOO]-	158.118651	148.8
[M+CH3COO]-	172.134301	171.1
[M+Na-2H]-	134.095116	129.4
[M]+	113.11990142	121.0
[M]-	113.12099858	121.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe