CID 15959200

N,7b-dibutyl-6-chloro-2-oxo-1,3-dihydrocyclopropa[c]quinoline-1a-carboxamide

Structural Information

Molecular Formula
C19H25ClN2O2
SMILES
CCCCC12CC1(C(=O)NC3=C2C=C(C=C3)Cl)C(=O)NCCCC
InChI
InChI=1S/C19H25ClN2O2/c1-3-5-9-18-12-19(18,16(23)21-10-6-4-2)17(24)22-15-8-7-13(20)11-14(15)18/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,21,23)(H,22,24)
InChIKey
QAGKYGIJHLIPAO-UHFFFAOYSA-N
Compound name
N,7b-dibutyl-6-chloro-2-oxo-1,3-dihydrocyclopropa[c]quinoline-1a-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

348.16046 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.16774 182.9
[M+Na]+ 371.14968 192.1
[M-H]- 347.15318 185.3
[M+NH4]+ 366.19428 196.1
[M+K]+ 387.12362 185.4
[M+H-H2O]+ 331.15772 177.8
[M+HCOO]- 393.15866 193.9
[M+CH3COO]- 407.17431 215.4
[M+Na-2H]- 369.13513 187.2
[M]+ 348.15991 188.7
[M]- 348.16101 188.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.