CID 211064

22168-73-6

Structural Information

Molecular Formula
C24H37NO2
SMILES
CCCCCC(C)C(C)C1=CC(=C2C3=C(CCN(C3)C)C(OC2=C1)(C)C)O
InChI
InChI=1S/C24H37NO2/c1-7-8-9-10-16(2)17(3)18-13-21(26)23-19-15-25(6)12-11-20(19)24(4,5)27-22(23)14-18/h13-14,16-17,26H,7-12,15H2,1-6H3
InChIKey
HOQSLFZFFMMYMC-UHFFFAOYSA-N
Compound name
2,5,5-trimethyl-8-(3-methyloctan-2-yl)-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

371.28244 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.28972 197.2
[M+Na]+ 394.27166 202.3
[M-H]- 370.27516 199.1
[M+NH4]+ 389.31626 210.7
[M+K]+ 410.24560 198.5
[M+H-H2O]+ 354.27970 189.1
[M+HCOO]- 416.28064 206.2
[M+CH3COO]- 430.29629 223.9
[M+Na-2H]- 392.25711 196.0
[M]+ 371.28189 198.4
[M]- 371.28299 198.4
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