CID 424006

2-(9-julolidinylamino-2-oxazoline) dihydrochloride

Structural Information

Molecular Formula
C15H19N3O
SMILES
C1CC2=CC(=CC3=C2N(C1)CCC3)NC4=NCCO4
InChI
InChI=1S/C15H19N3O/c1-3-11-9-13(17-15-16-5-8-19-15)10-12-4-2-7-18(6-1)14(11)12/h9-10H,1-8H2,(H,16,17)
InChIKey
HCXNWVUPLARPPG-UHFFFAOYSA-N
Compound name
N-(1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.1528 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.160076 156.7
[M+Na]+ 280.142018 161.5
[M-H]- 256.145524 161.1
[M+NH4]+ 275.186623 172.8
[M+K]+ 296.115958 158.2
[M+H-H2O]+ 240.150060 147.4
[M+HCOO]- 302.151001 171.6
[M+CH3COO]- 316.166651 166.9
[M+Na-2H]- 278.127466 162.3
[M]+ 257.15225142 152.1
[M]- 257.15334858 152.1
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.