CID 379218

2-oxazoline, 2-(2-(1-naphthyl)ethylamino)-, hydrobromide

Structural Information

Molecular Formula
C15H16N2O
SMILES
C1COC(=N1)NCCC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C15H16N2O/c1-2-7-14-12(4-1)5-3-6-13(14)8-9-16-15-17-10-11-18-15/h1-7H,8-11H2,(H,16,17)
InChIKey
XKIIHBYDGWKACY-UHFFFAOYSA-N
Compound name
N-(2-naphthalen-1-ylethyl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.12627 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.13355 153.0
[M+Na]+ 263.11549 159.8
[M-H]- 239.11899 159.5
[M+NH4]+ 258.16009 170.2
[M+K]+ 279.08943 156.5
[M+H-H2O]+ 223.12353 144.8
[M+HCOO]- 285.12447 175.3
[M+CH3COO]- 299.14012 165.3
[M+Na-2H]- 261.10094 160.4
[M]+ 240.12572 152.7
[M]- 240.12682 152.7
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.