CID 27317

15475-47-5

Structural Information

Molecular Formula
C20H25NO
SMILES
CC1=CC2=C(CCC3=CC=CC=C3C2OCCN(C)C)C=C1
InChI
InChI=1S/C20H25NO/c1-15-8-9-17-11-10-16-6-4-5-7-18(16)20(19(17)14-15)22-13-12-21(2)3/h4-9,14,20H,10-13H2,1-3H3
InChIKey
HODWYBOXZYFAJD-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[(5-methyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.1936 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.200876 169.3
[M+Na]+ 318.182818 174.6
[M-H]- 294.186324 176.7
[M+NH4]+ 313.227423 186.5
[M+K]+ 334.156758 175.1
[M+H-H2O]+ 278.190860 163.6
[M+HCOO]- 340.191801 189.5
[M+CH3COO]- 354.207451 213.3
[M+Na-2H]- 316.168266 174.1
[M]+ 295.19305142 169.0
[M]- 295.19414858 169.0
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.