CID 14400165

2,7-octadienal, 2-methyl-6-methylene-, (e)-

Structural Information

Molecular Formula
C10H14O
SMILES
C/C(=C\CCC(=C)C=C)/C=O
InChI
InChI=1S/C10H14O/c1-4-9(2)6-5-7-10(3)8-11/h4,7-8H,1-2,5-6H2,3H3/b10-7+
InChIKey
NDYNCPVWWPJJKN-JXMROGBWSA-N
Compound name
(2E)-2-methyl-6-methylideneocta-2,7-dienal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

150.10446 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.11174 136.7
[M+Na]+ 173.09368 146.6
[M+NH4]+ 168.13828 143.6
[M+K]+ 189.06762 140.4
[M-H]- 149.09718 135.4
[M+Na-2H]- 171.07913 139.2
[M]+ 150.10391 137.4
[M]- 150.10501 137.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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