CID 16684147

Aluminum, didecyl((3z)-3-tetradecen-1-olato)-

Structural Information

Molecular Formula
C34H69AlO
SMILES
CCCCCCCCCC/C=C/CCO[Al](CCCCCCCCCC)CCCCCCCCCC
InChI
InChI=1S/C14H27O.2C10H21.Al/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15;2*1-3-5-7-9-10-8-6-4-2;/h11-12H,2-10,13-14H2,1H3;2*1,3-10H2,2H3;/q-1;;;+1/b12-11+;;;
InChIKey
GGGHJGZAWXDWLH-UECMSYGKSA-N
Compound name
didecyl-[(E)-tetradec-3-enoxy]alumane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

520.51636 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 521.52364 252.0
[M+Na]+ 543.50558 258.1
[M-H]- 519.50908 232.0
[M+NH4]+ 538.55018 249.7
[M+K]+ 559.47952 258.9
[M+H-H2O]+ 503.51362 241.5
[M+HCOO]- 565.51456 259.3
[M+CH3COO]- 579.53021 254.3
[M+Na-2H]- 541.49103 241.8
[M]+ 520.51581 252.6
[M]- 520.51691 252.6
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.