CID 6430401

15,19-dimethylhexatriacontane

Structural Information

Molecular Formula
C38H78
SMILES
CCCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCCCCCC
InChI
InChI=1S/C38H78/c1-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-34-38(4)36-32-35-37(3)33-30-28-26-24-22-18-16-14-12-10-8-6-2/h37-38H,5-36H2,1-4H3
InChIKey
UONOWMXUVWVCQA-UHFFFAOYSA-N
Compound name
15,19-dimethylhexatriacontane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

534.61035 Da
Monoisotopic Mass

20.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 535.61763 259.6
[M+Na]+ 557.59957 265.6
[M-H]- 533.60307 238.6
[M+NH4]+ 552.64417 257.7
[M+K]+ 573.57351 268.7
[M+H-H2O]+ 517.60761 259.0
[M+HCOO]- 579.60855 262.5
[M+CH3COO]- 593.62420 263.1
[M+Na-2H]- 555.58502 243.1
[M]+ 534.60980 260.7
[M]- 534.61090 260.7
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.