CID 66201008

1188908-83-9

Structural Information

Molecular Formula

C₈H₁₂N₂O

SMILES

C1CCC(C1)C2=CC(=NO2)N

InChI

InChI=1S/C8H12N2O/c9-8-5-7(11-10-8)6-3-1-2-4-6/h5-6H,1-4H2,(H2,9,10)

InChIKey

SXLATPWUODSFIA-UHFFFAOYSA-N

Compound name

5-cyclopentyl-1,2-oxazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 30
Patents: 152.09496 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]+	153.102236	130.5
[M+Na]+	175.084178	137.5
[M-H]-	151.087684	136.1
[M+NH4]+	170.128783	151.8
[M+K]+	191.058118	137.0
[M+H-H2O]+	135.092220	124.1
[M+HCOO]-	197.093161	153.9
[M+CH3COO]-	211.108811	144.4
[M+Na-2H]-	173.069626	134.3
[M]+	152.09441142	127.4
[M]-	152.09550858	127.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe