CID 3040348

K 8148

Structural Information

Molecular Formula
C22H26N2O3
SMILES
CCN(CC)C1=C(C(=O)C2=C(O1)C=CC3=CC=CC=C32)CN4CCOCC4
InChI
InChI=1S/C22H26N2O3/c1-3-24(4-2)22-18(15-23-11-13-26-14-12-23)21(25)20-17-8-6-5-7-16(17)9-10-19(20)27-22/h5-10H,3-4,11-15H2,1-2H3
InChIKey
CIUYDDYZOLILNU-UHFFFAOYSA-N
Compound name
3-(diethylamino)-2-(morpholin-4-ylmethyl)benzo[f]chromen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.19434 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.201616 189.9
[M+Na]+ 389.183558 196.7
[M-H]- 365.187064 198.8
[M+NH4]+ 384.228163 200.3
[M+K]+ 405.157498 194.5
[M+H-H2O]+ 349.191600 178.8
[M+HCOO]- 411.192541 206.8
[M+CH3COO]- 425.208191 199.8
[M+Na-2H]- 387.169006 195.3
[M]+ 366.19379142 193.2
[M]- 366.19488858 193.2
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.