CID 12838326

Hexadecyl isopropyl ether

Structural Information

Molecular Formula
C19H40O
SMILES
CCCCCCCCCCCCCCCCOC(C)C
InChI
InChI=1S/C19H40O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19(2)3/h19H,4-18H2,1-3H3
InChIKey
CEXOLTXCCQUWDT-UHFFFAOYSA-N
Compound name
1-propan-2-yloxyhexadecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

284.30792 Da
Monoisotopic Mass

8.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.315196 182.2
[M+Na]+ 307.297138 183.8
[M-H]- 283.300644 180.1
[M+NH4]+ 302.341743 198.3
[M+K]+ 323.271078 181.1
[M+H-H2O]+ 267.305180 175.3
[M+HCOO]- 329.306121 200.9
[M+CH3COO]- 343.321771 209.2
[M+Na-2H]- 305.282586 180.9
[M]+ 284.30737142 189.2
[M]- 284.30846858 189.2
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

patents stripe