CID 263672

7515-69-7

Structural Information

Molecular Formula

C₁₀H₁₅Cl

SMILES

C1CC1C(=CCCCl)C2CC2

InChI

InChI=1S/C10H15Cl/c11-7-1-2-10(8-3-4-8)9-5-6-9/h2,8-9H,1,3-7H2

InChIKey

VZHMUSDBQCLUNB-UHFFFAOYSA-N

Compound name

(4-chloro-1-cyclopropylbut-1-enyl)cyclopropane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 170.08623 Da
Monoisotopic Mass: 3.9
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]+	171.09351	141.6
[M+Na]+	193.07545	148.3
[M-H]-	169.07895	148.0
[M+NH4]+	188.12005	151.2
[M+K]+	209.04939	145.4
[M+H-H2O]+	153.08349	135.9
[M+HCOO]-	215.08443	157.3
[M+CH3COO]-	229.10008	192.4
[M+Na-2H]-	191.06090	144.3
[M]+	170.08568	145.3
[M]-	170.08678	145.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe