CID 6436616

(z)-oct-5-en-2-ol

Structural Information

Molecular Formula
C8H16O
SMILES
CC/C=C\CCC(C)O
InChI
InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h4-5,8-9H,3,6-7H2,1-2H3/b5-4-
InChIKey
LZHHQGKEJNRBAZ-PLNGDYQASA-N
Compound name
(Z)-oct-5-en-2-ol
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 130.9
[M+Na]+ 151.109338 137.1
[M-H]- 127.112844 129.6
[M+NH4]+ 146.153943 152.6
[M+K]+ 167.083278 135.8
[M+H-H2O]+ 111.117380 126.7
[M+HCOO]- 173.118321 152.0
[M+CH3COO]- 187.133971 171.8
[M+Na-2H]- 149.094786 135.2
[M]+ 128.11957142 131.0
[M]- 128.12066858 131.0
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.