CID 49401

5h-dibenzo(a,d)cycloheptene-delta(sup 5),gamma-propylamine, 10,11-dihydro-n-methoxy-n-methyl-

Structural Information

Molecular Formula
C20H23NO
SMILES
CN(CCC=C1C2=CC=CC=C2CCC3=CC=CC=C31)OC
InChI
InChI=1S/C20H23NO/c1-21(22-2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3
InChIKey
KZLGHJSDDRLNGF-UHFFFAOYSA-N
Compound name
N-methoxy-N-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.17798 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.18526 168.9
[M+Na]+ 316.16720 180.6
[M+NH4]+ 311.21180 177.7
[M+K]+ 332.14114 172.9
[M-H]- 292.17070 173.4
[M+Na-2H]- 314.15265 175.4
[M]+ 293.17743 172.0
[M]- 293.17853 172.0
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.