CID 11789950

11-aminoundecan-1-ol

Structural Information

Molecular Formula
C11H25NO
SMILES
C(CCCCCN)CCCCCO
InChI
InChI=1S/C11H25NO/c12-10-8-6-4-2-1-3-5-7-9-11-13/h13H,1-12H2
InChIKey
QCSCNTGILDKNRW-UHFFFAOYSA-N
Compound name
11-aminoundecan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

245
Patents

187.19362 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.200896 149.4
[M+Na]+ 210.182838 153.2
[M-H]- 186.186344 146.7
[M+NH4]+ 205.227443 168.1
[M+K]+ 226.156778 150.8
[M+H-H2O]+ 170.190880 143.7
[M+HCOO]- 232.191821 170.7
[M+CH3COO]- 246.207471 185.8
[M+Na-2H]- 208.168286 152.4
[M]+ 187.19307142 150.3
[M]- 187.19416858 150.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe