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
3
Annotation Hits

0
References

99
Patents

154.13577 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.14305 137.2
[M+Na]+ 177.12499 143.6
[M-H]- 153.12849 137.0
[M+NH4]+ 172.16959 158.7
[M+K]+ 193.09893 141.8
[M+H-H2O]+ 137.13303 132.4
[M+HCOO]- 199.13397 160.5
[M+CH3COO]- 213.14962 178.3
[M+Na-2H]- 175.11044 142.4
[M]+ 154.13522 140.0
[M]- 154.13632 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