CID 206155

Brn 0840917

Structural Information

Molecular Formula
C21H23NO3
SMILES
COC1=C(C2=C(C=C1)C(C3=CC=CC=C3C=C2)O)CN4CCOCC4
InChI
InChI=1S/C21H23NO3/c1-24-20-9-8-18-17(19(20)14-22-10-12-25-13-11-22)7-6-15-4-2-3-5-16(15)21(18)23/h2-9,21,23H,10-14H2,1H3
InChIKey
FFWHUABMHMTJDI-UHFFFAOYSA-N
Compound name
6-methoxy-7-(morpholin-4-ylmethyl)tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.1678 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.17508 183.4
[M+Na]+ 360.15702 196.2
[M+NH4]+ 355.20162 191.2
[M+K]+ 376.13096 189.3
[M-H]- 336.16052 189.0
[M+Na-2H]- 358.14247 188.7
[M]+ 337.16725 187.0
[M]- 337.16835 187.0
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.