CID 411695

3,4-dimethylaminorex

Structural Information

Molecular Formula
C11H14N2O
SMILES
CC1C(OC(=N)N1C)C2=CC=CC=C2
InChI
InChI=1S/C11H14N2O/c1-8-10(14-11(12)13(8)2)9-6-4-3-5-7-9/h3-8,10,12H,1-2H3
InChIKey
AINPTMZQNYUGDW-UHFFFAOYSA-N
Compound name
3,4-dimethyl-5-phenyl-1,3-oxazolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

190.11061 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 141.5
[M+Na]+ 213.09983 149.7
[M-H]- 189.10333 147.9
[M+NH4]+ 208.14443 160.3
[M+K]+ 229.07377 147.7
[M+H-H2O]+ 173.10787 134.6
[M+HCOO]- 235.10881 164.0
[M+CH3COO]- 249.12446 185.6
[M+Na-2H]- 211.08528 145.7
[M]+ 190.11006 139.8
[M]- 190.11116 139.8
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.