CID 47003050

Methyl[5-(3-phenyl-1,2-oxazol-5-yl)pentyl]amine hydrochloride

Structural Information

Molecular Formula
C15H20N2O
SMILES
CNCCCCCC1=CC(=NO1)C2=CC=CC=C2
InChI
InChI=1S/C15H20N2O/c1-16-11-7-3-6-10-14-12-15(17-18-14)13-8-4-2-5-9-13/h2,4-5,8-9,12,16H,3,6-7,10-11H2,1H3
InChIKey
ATOIROAQNNKLGH-UHFFFAOYSA-N
Compound name
N-methyl-5-(3-phenyl-1,2-oxazol-5-yl)pentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.15756 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.16484 157.6
[M+Na]+ 267.14678 163.9
[M-H]- 243.15028 163.2
[M+NH4]+ 262.19138 173.8
[M+K]+ 283.12072 161.1
[M+H-H2O]+ 227.15482 149.3
[M+HCOO]- 289.15576 181.5
[M+CH3COO]- 303.17141 195.5
[M+Na-2H]- 265.13223 163.1
[M]+ 244.15701 160.0
[M]- 244.15811 160.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.