CID 11014808

Decyltetradecylamine oxide

Structural Information

Molecular Formula
C26H55NO
SMILES
CCCCCCCCCCCCC(CCCCCCCCCC)C[N+](C)(C)[O-]
InChI
InChI=1S/C26H55NO/c1-5-7-9-11-13-15-16-18-20-22-24-26(25-27(3,4)28)23-21-19-17-14-12-10-8-6-2/h26H,5-25H2,1-4H3
InChIKey
NIFPWUCDSCRTCA-UHFFFAOYSA-N
Compound name
2-decyl-N,N-dimethyltetradecan-1-amine oxide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

619
Patents

397.42838 Da
Monoisotopic Mass

11.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 398.43566 232.2
[M+Na]+ 420.41760 237.8
[M-H]- 396.42110 218.0
[M+NH4]+ 415.46220 230.8
[M+K]+ 436.39154 238.8
[M+H-H2O]+ 380.42564 215.5
[M+HCOO]- 442.42658 244.0
[M+CH3COO]- 456.44223 228.7
[M+Na-2H]- 418.40305 216.3
[M]+ 397.42783 231.4
[M]- 397.42893 231.4
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