CID 57723336

2',3'-dihydro-1'h-spiro[cyclopropane-1,4'-quinoline]

Structural Information

Molecular Formula

C₁₁H₁₃N

SMILES

C1CC12CCNC3=CC=CC=C23

InChI

InChI=1S/C11H13N/c1-2-4-10-9(3-1)11(5-6-11)7-8-12-10/h1-4,12H,5-8H2

InChIKey

ZFHFVUIJOYMULN-UHFFFAOYSA-N

Compound name

spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 159.1048 Da
Monoisotopic Mass: 3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	160.11208	137.8
[M+Na]+	182.09402	146.9
[M-H]-	158.09752	142.2
[M+NH4]+	177.13862	154.9
[M+K]+	198.06796	143.1
[M+H-H2O]+	142.10206	131.1
[M+HCOO]-	204.10300	156.1
[M+CH3COO]-	218.11865	150.0
[M+Na-2H]-	180.07947	147.0
[M]+	159.10425	135.1
[M]-	159.10535	135.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe