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]+	171.093506	141.6
[M+Na]+	193.075448	148.3
[M-H]-	169.078954	148.0
[M+NH4]+	188.120053	151.2
[M+K]+	209.049388	145.4
[M+H-H2O]+	153.083490	135.9
[M+HCOO]-	215.084431	157.3
[M+CH3COO]-	229.100081	192.4
[M+Na-2H]-	191.060896	144.3
[M]+	170.08568142	145.3
[M]-	170.08677858	145.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe