CID 12677171

N-(4,4-diethoxybutyl)acetamide

Structural Information

Molecular Formula
C10H21NO3
SMILES
CCOC(CCCNC(=O)C)OCC
InChI
InChI=1S/C10H21NO3/c1-4-13-10(14-5-2)7-6-8-11-9(3)12/h10H,4-8H2,1-3H3,(H,11,12)
InChIKey
ANONYJUYWUFMOA-UHFFFAOYSA-N
Compound name
N-(4,4-diethoxybutyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

203.15215 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.15943 150.0
[M+Na]+ 226.14137 154.5
[M-H]- 202.14487 149.6
[M+NH4]+ 221.18597 168.8
[M+K]+ 242.11531 154.9
[M+H-H2O]+ 186.14941 144.0
[M+HCOO]- 248.15035 172.4
[M+CH3COO]- 262.16600 190.1
[M+Na-2H]- 224.12682 152.5
[M]+ 203.15160 154.2
[M]- 203.15270 154.2
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