CID 2274383

Cbmicro_014926

Structural Information

Molecular Formula
C16H20N2O3
SMILES
CCCCCCNC(=O)CN1C(=O)C2=CC=CC=C2C1=O
InChI
InChI=1S/C16H20N2O3/c1-2-3-4-7-10-17-14(19)11-18-15(20)12-8-5-6-9-13(12)16(18)21/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,17,19)
InChIKey
QBLSVDUWLXBMTH-UHFFFAOYSA-N
Compound name
2-(1,3-dioxoisoindol-2-yl)-N-hexylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.1474 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.154676 167.8
[M+Na]+ 311.136618 174.7
[M-H]- 287.140124 170.6
[M+NH4]+ 306.181223 184.9
[M+K]+ 327.110558 170.9
[M+H-H2O]+ 271.144660 160.5
[M+HCOO]- 333.145601 189.1
[M+CH3COO]- 347.161251 205.0
[M+Na-2H]- 309.122066 169.3
[M]+ 288.14685142 170.7
[M]- 288.14794858 170.7
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

No patent data available for this compound.