CID 29075

1-nonadecene

Structural Information

Molecular Formula
C19H38
SMILES
CCCCCCCCCCCCCCCCCC=C
InChI
InChI=1S/C19H38/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3H,1,4-19H2,2H3
InChIKey
NHLUYCJZUXOUBX-UHFFFAOYSA-N
Compound name
nonadec-1-ene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

3
References

14286
Patents

266.29736 Da
Monoisotopic Mass

10.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.30464 176.1
[M+Na]+ 289.28658 178.3
[M-H]- 265.29008 174.0
[M+NH4]+ 284.33118 193.0
[M+K]+ 305.26052 174.1
[M+H-H2O]+ 249.29462 169.5
[M+HCOO]- 311.29556 195.8
[M+CH3COO]- 325.31121 205.9
[M+Na-2H]- 287.27203 176.3
[M]+ 266.29681 181.7
[M]- 266.29791 181.7
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