CID 56842003

Einecs 257-241-1

Structural Information

Molecular Formula
C22H25N3O2
SMILES
CCN(CC)C1=CC2=C(C=C1)C=CC3(O2)C(=O)N(C4=CC=CC=C4N3C)C
InChI
InChI=1S/C22H25N3O2/c1-5-25(6-2)17-12-11-16-13-14-22(27-20(16)15-17)21(26)23(3)18-9-7-8-10-19(18)24(22)4/h7-15H,5-6H2,1-4H3
InChIKey
ZXYGXVPPZLKHDH-UHFFFAOYSA-N
Compound name
7-(diethylamino)-1',4'-dimethylspiro[chromene-2,3'-quinoxaline]-2'-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.19467 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.201946 190.5
[M+Na]+ 386.183888 198.9
[M-H]- 362.187394 196.8
[M+NH4]+ 381.228493 203.8
[M+K]+ 402.157828 195.0
[M+H-H2O]+ 346.191930 179.1
[M+HCOO]- 408.192871 205.3
[M+CH3COO]- 422.208521 200.1
[M+Na-2H]- 384.169336 195.4
[M]+ 363.19412142 192.4
[M]- 363.19521858 192.4
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

No patent data available for this compound.