CID 3024494

N-(6-aminohexyl)-6-hydroxyhexanamide

Structural Information

Molecular Formula
C12H26N2O2
SMILES
C(CCCNC(=O)CCCCCO)CCN
InChI
InChI=1S/C12H26N2O2/c13-9-5-1-2-6-10-14-12(16)8-4-3-7-11-15/h15H,1-11,13H2,(H,14,16)
InChIKey
PPTSELWQYYWEQG-UHFFFAOYSA-N
Compound name
N-(6-aminohexyl)-6-hydroxyhexanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

230.19943 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.206706 159.4
[M+Na]+ 253.188648 161.9
[M-H]- 229.192154 156.4
[M+NH4]+ 248.233253 175.7
[M+K]+ 269.162588 159.6
[M+H-H2O]+ 213.196690 152.7
[M+HCOO]- 275.197631 180.7
[M+CH3COO]- 289.213281 195.2
[M+Na-2H]- 251.174096 160.8
[M]+ 230.19888142 159.7
[M]- 230.19997858 159.7
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