CID 9570526

34144-37-1

Structural Information

Molecular Formula
C18H21N3O
SMILES
CN(C)CCO/N=C/1\C2=C(CCC3=CC=CC=C31)N=CC=C2
InChI
InChI=1S/C18H21N3O/c1-21(2)12-13-22-20-18-15-7-4-3-6-14(15)9-10-17-16(18)8-5-11-19-17/h3-8,11H,9-10,12-13H2,1-2H3/b20-18-
InChIKey
KSWPYTWRTVSOJG-ZZEZOPTASA-N
Compound name
2-[(Z)-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ylideneamino]oxy-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.16846 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.17574 168.8
[M+Na]+ 318.15768 179.9
[M+NH4]+ 313.20228 177.0
[M+K]+ 334.13162 173.0
[M-H]- 294.16118 173.2
[M+Na-2H]- 316.14313 175.5
[M]+ 295.16791 171.7
[M]- 295.16901 171.7
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.