CID 15439

1,9-decadiene

Structural Information

Molecular Formula
C10H18
SMILES
C=CCCCCCCC=C
InChI
InChI=1S/C10H18/c1-3-5-7-9-10-8-6-4-2/h3-4H,1-2,5-10H2
InChIKey
NLDGJRWPPOSWLC-UHFFFAOYSA-N
Compound name
deca-1,9-diene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

21020
Patents

138.14085 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.148126 133.5
[M+Na]+ 161.130068 139.7
[M-H]- 137.133574 133.2
[M+NH4]+ 156.174673 155.4
[M+K]+ 177.104008 137.4
[M+H-H2O]+ 121.138110 128.9
[M+HCOO]- 183.139051 156.4
[M+CH3COO]- 197.154701 177.8
[M+Na-2H]- 159.115516 138.7
[M]+ 138.14030142 135.0
[M]- 138.14139858 135.0
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

patents stripe