CID 181154

1-tricosene

Structural Information

Molecular Formula
C23H46
SMILES
CCCCCCCCCCCCCCCCCCCCCC=C
InChI
InChI=1S/C23H46/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-23H2,2H3
InChIKey
SJDSOBWGZRPKSB-UHFFFAOYSA-N
Compound name
tricos-1-ene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

4
References

2983
Patents

322.35995 Da
Monoisotopic Mass

12.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.36723 193.8
[M+Na]+ 345.34917 194.3
[M-H]- 321.35267 190.9
[M+NH4]+ 340.39377 208.4
[M+K]+ 361.32311 189.0
[M+H-H2O]+ 305.35721 186.4
[M+HCOO]- 367.35815 212.2
[M+CH3COO]- 381.37380 217.8
[M+Na-2H]- 343.33462 191.9
[M]+ 322.35940 200.9
[M]- 322.36050 200.9
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