CID 207974

Propionamide, n-(1-azulenyl)-3-morpholino-, hydrochloride

Structural Information

Molecular Formula
C17H20N2O2
SMILES
C1COCCN1CCC(=O)NC2=C3C=CC=CC=C3C=C2
InChI
InChI=1S/C17H20N2O2/c20-17(8-9-19-10-12-21-13-11-19)18-16-7-6-14-4-2-1-3-5-15(14)16/h1-7H,8-13H2,(H,18,20)
InChIKey
BGDYJCXFFBKUIE-UHFFFAOYSA-N
Compound name
N-azulen-1-yl-3-morpholin-4-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.15247 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.15975 165.6
[M+Na]+ 307.14169 169.2
[M-H]- 283.14519 172.8
[M+NH4]+ 302.18629 179.8
[M+K]+ 323.11563 170.1
[M+H-H2O]+ 267.14973 158.0
[M+HCOO]- 329.15067 184.6
[M+CH3COO]- 343.16632 175.8
[M+Na-2H]- 305.12714 169.3
[M]+ 284.15192 161.7
[M]- 284.15302 161.7
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.