CID 6441357

10-undecenal, 2-ethylidene-

Structural Information

Molecular Formula
C13H22O
SMILES
C/C=C(\CCCCCCCC=C)/C=O
InChI
InChI=1S/C13H22O/c1-3-5-6-7-8-9-10-11-13(4-2)12-14/h3-4,12H,1,5-11H2,2H3/b13-4+
InChIKey
BGAYGLVXLJBTTR-YIXHJXPBSA-N
Compound name
(2E)-2-ethylideneundec-10-enal
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

194.16707 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.17435 149.7
[M+Na]+ 217.15629 154.8
[M-H]- 193.15979 148.9
[M+NH4]+ 212.20089 169.3
[M+K]+ 233.13023 151.9
[M+H-H2O]+ 177.16433 144.4
[M+HCOO]- 239.16527 171.1
[M+CH3COO]- 253.18092 187.9
[M+Na-2H]- 215.14174 151.9
[M]+ 194.16652 152.3
[M]- 194.16762 152.3
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.