CID 106477

6-hydroxy-n,n-bis(2-hydroxyethyl)hexanamide

Structural Information

Molecular Formula
C10H21NO4
SMILES
C(CCC(=O)N(CCO)CCO)CCO
InChI
InChI=1S/C10H21NO4/c12-7-3-1-2-4-10(15)11(5-8-13)6-9-14/h12-14H,1-9H2
InChIKey
ISYSXHXTFFZRKN-UHFFFAOYSA-N
Compound name
6-hydroxy-N,N-bis(2-hydroxyethyl)hexanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

219.14706 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.15434 153.3
[M+Na]+ 242.13628 156.8
[M-H]- 218.13978 149.9
[M+NH4]+ 237.18088 169.9
[M+K]+ 258.11022 156.0
[M+H-H2O]+ 202.14432 147.4
[M+HCOO]- 264.14526 172.9
[M+CH3COO]- 278.16091 187.1
[M+Na-2H]- 240.12173 154.8
[M]+ 219.14651 155.1
[M]- 219.14761 155.1
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