CID 216114

39123-15-4

Structural Information

Molecular Formula
C22H25NO3
SMILES
C1COCCN1CCOC(=O)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H25NO3/c24-21(26-16-13-23-11-14-25-15-12-23)20-17-22(20,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-10,20H,11-17H2
InChIKey
OOZJVBCYUYRJTH-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl 2,2-diphenylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

351.18344 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.19072 185.0
[M+Na]+ 374.17266 190.0
[M-H]- 350.17616 195.8
[M+NH4]+ 369.21726 191.4
[M+K]+ 390.14660 188.0
[M+H-H2O]+ 334.18070 174.7
[M+HCOO]- 396.18164 201.7
[M+CH3COO]- 410.19729 193.8
[M+Na-2H]- 372.15811 188.2
[M]+ 351.18289 185.5
[M]- 351.18399 185.5
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