CID 13829221

1-tetratriacontene

Structural Information

Molecular Formula
C34H68
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C
InChI
InChI=1S/C34H68/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-34H2,2H3
InChIKey
AQUWSCLUQRAMPO-UHFFFAOYSA-N
Compound name
tetratriacont-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

268
Patents

476.5321 Da
Monoisotopic Mass

18.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 477.53938 240.6
[M+Na]+ 499.52132 236.5
[M-H]- 475.52482 222.1
[M+NH4]+ 494.56592 239.3
[M+K]+ 515.49526 228.3
[M+H-H2O]+ 459.52936 231.1
[M+HCOO]- 521.53030 253.8
[M+CH3COO]- 535.54595 249.8
[M+Na-2H]- 497.50677 232.9
[M]+ 476.53155 251.8
[M]- 476.53265 251.8
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