CID 89704529

3-hexene, 1-(2-buten-1-yloxy)-, (3z)-

Structural Information

Molecular Formula
C10H18O
SMILES
CC/C=C\CCOC/C=C/C
InChI
InChI=1S/C10H18O/c1-3-5-7-8-10-11-9-6-4-2/h4-7H,3,8-10H2,1-2H3/b6-4+,7-5-
InChIKey
SGRPYYYZQSBLEY-GUBXDBFYSA-N
Compound name
(Z)-1-[(E)-but-2-enoxy]hex-3-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

71
Patents

154.13577 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.143046 137.2
[M+Na]+ 177.124988 143.6
[M-H]- 153.128494 137.0
[M+NH4]+ 172.169593 158.7
[M+K]+ 193.098928 141.8
[M+H-H2O]+ 137.133030 132.4
[M+HCOO]- 199.133971 160.5
[M+CH3COO]- 213.149621 178.3
[M+Na-2H]- 175.110436 142.4
[M]+ 154.13522142 140.0
[M]- 154.13631858 140.0
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