CID 345548

11-bromoundecanamide

Structural Information

Molecular Formula
C11H22BrNO
SMILES
C(CCCCCBr)CCCCC(=O)N
InChI
InChI=1S/C11H22BrNO/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10H2,(H2,13,14)
InChIKey
NHUWVMSJSKNFHL-UHFFFAOYSA-N
Compound name
11-bromoundecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

263.08847 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.09575 159.1
[M+Na]+ 286.07769 166.8
[M-H]- 262.08119 160.5
[M+NH4]+ 281.12229 178.8
[M+K]+ 302.05163 154.9
[M+H-H2O]+ 246.08573 157.9
[M+HCOO]- 308.08667 178.4
[M+CH3COO]- 322.10232 197.8
[M+Na-2H]- 284.06314 162.2
[M]+ 263.08792 178.5
[M]- 263.08902 178.5
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