CID 5365079

2-pentene, 1-ethoxy-4-methyl-, (z)-

Structural Information

Molecular Formula
C8H16O
SMILES
CCOC/C=C\C(C)C
InChI
InChI=1S/C8H16O/c1-4-9-7-5-6-8(2)3/h5-6,8H,4,7H2,1-3H3/b6-5-
InChIKey
XLTXOKDODGBUDF-WAYWQWQTSA-N
Compound name
(Z)-1-ethoxy-4-methylpent-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

128.12012 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.127396 129.9
[M+Na]+ 151.109338 136.5
[M-H]- 127.112844 130.1
[M+NH4]+ 146.153943 152.4
[M+K]+ 167.083278 136.2
[M+H-H2O]+ 111.117380 125.5
[M+HCOO]- 173.118321 152.6
[M+CH3COO]- 187.133971 174.6
[M+Na-2H]- 149.094786 134.8
[M]+ 128.11957142 132.0
[M]- 128.12066858 132.0
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

No patent data available for this compound.