CID 3052115

68484-43-5

Structural Information

Molecular Formula
C24H34N2O2
SMILES
CC1=C(C2=C(COC2)C(=N1)CC3=CC=CC=C3)OCCC(C)CCNC(C)C
InChI
InChI=1S/C24H34N2O2/c1-17(2)25-12-10-18(3)11-13-28-24-19(4)26-23(21-15-27-16-22(21)24)14-20-8-6-5-7-9-20/h5-9,17-18,25H,10-16H2,1-4H3
InChIKey
LEMLOMDGSUCQBC-UHFFFAOYSA-N
Compound name
5-[(4-benzyl-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-7-yl)oxy]-3-methyl-N-propan-2-ylpentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

382.26202 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.26930 200.1
[M+Na]+ 405.25124 203.6
[M-H]- 381.25474 205.7
[M+NH4]+ 400.29584 211.5
[M+K]+ 421.22518 200.0
[M+H-H2O]+ 365.25928 190.6
[M+HCOO]- 427.26022 217.2
[M+CH3COO]- 441.27587 226.3
[M+Na-2H]- 403.23669 198.7
[M]+ 382.26147 203.8
[M]- 382.26257 203.8
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

patents stripe