CID 56936193

5,9-tricosadiene

Structural Information

Molecular Formula
C23H44
SMILES
CCCCCCCCCCCCC/C=C/CC/C=C/CCCC
InChI
InChI=1S/C23H44/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h9,11,17,19H,3-8,10,12-16,18,20-23H2,1-2H3/b11-9+,19-17+
InChIKey
MNTTZIKPNMRXFI-QNBOAHBYSA-N
Compound name
(5E,9E)-tricosa-5,9-diene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.3443 Da
Monoisotopic Mass

10.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.35158 192.5
[M+Na]+ 343.33352 193.5
[M-H]- 319.33702 189.7
[M+NH4]+ 338.37812 207.3
[M+K]+ 359.30746 187.6
[M+H-H2O]+ 303.34156 185.3
[M+HCOO]- 365.34250 211.1
[M+CH3COO]- 379.35815 215.6
[M+Na-2H]- 341.31897 190.6
[M]+ 320.34375 198.8
[M]- 320.34485 198.8
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.