CID 3051188

67293-81-6

Structural Information

Molecular Formula
C12H15NO
SMILES
CN1CC2CC(C1)OC3=CC=CC=C23
InChI
InChI=1S/C12H15NO/c1-13-7-9-6-10(8-13)14-12-5-3-2-4-11(9)12/h2-5,9-10H,6-8H2,1H3
InChIKey
UFYJHAWVSCNDFY-UHFFFAOYSA-N
Compound name
11-methyl-8-oxa-11-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.11537 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.12265 140.8
[M+Na]+ 212.10459 154.9
[M+NH4]+ 207.14919 151.6
[M+K]+ 228.07853 147.1
[M-H]- 188.10809 145.1
[M+Na-2H]- 210.09004 145.3
[M]+ 189.11482 144.2
[M]- 189.11592 144.2
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.