CID 14085932

1-(but-3-en-1-yloxy)-4-chlorobenzene

Structural Information

Molecular Formula
C10H11ClO
SMILES
C=CCCOC1=CC=C(C=C1)Cl
InChI
InChI=1S/C10H11ClO/c1-2-3-8-12-10-6-4-9(11)5-7-10/h2,4-7H,1,3,8H2
InChIKey
CQUQTUKNRMFHRT-UHFFFAOYSA-N
Compound name
1-but-3-enoxy-4-chlorobenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

182.04984 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.05712 135.9
[M+Na]+ 205.03906 144.9
[M-H]- 181.04256 139.5
[M+NH4]+ 200.08366 157.0
[M+K]+ 221.01300 140.7
[M+H-H2O]+ 165.04710 131.2
[M+HCOO]- 227.04804 156.0
[M+CH3COO]- 241.06369 180.5
[M+Na-2H]- 203.02451 142.5
[M]+ 182.04929 139.3
[M]- 182.05039 139.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe