CID 10825540

173074-85-6

Structural Information

Molecular Formula

C₁₈H₃₂O

SMILES

CCCCCCCC/C=C\CCCCC1CCC1=O

InChI

InChI=1S/C18H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-15-16-18(17)19/h9-10,17H,2-8,11-16H2,1H3/b10-9-

InChIKey

ITFDRFJPWYWSMZ-KTKRTIGZSA-N

Compound name

2-[(Z)-tetradec-5-enyl]cyclobutan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 264.24533 Da
Monoisotopic Mass: 6.5
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]+	265.25261	170.2
[M+Na]+	287.23455	175.0
[M+NH4]+	282.27915	173.2
[M+K]+	303.20849	168.1
[M-H]-	263.23805	168.3
[M+Na-2H]-	285.22000	170.0
[M]+	264.24478	168.9
[M]-	264.24588	168.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.