CID 209599

Benzamide, n-(2-propynyloxy)-

Structural Information

Molecular Formula
C10H9NO2
SMILES
C#CCONC(=O)C1=CC=CC=C1
InChI
InChI=1S/C10H9NO2/c1-2-8-13-11-10(12)9-6-4-3-5-7-9/h1,3-7H,8H2,(H,11,12)
InChIKey
AQYNGRBVFDEDBJ-UHFFFAOYSA-N
Compound name
N-prop-2-ynoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

175.06332 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.07060 139.5
[M+Na]+ 198.05254 148.4
[M-H]- 174.05604 141.4
[M+NH4]+ 193.09714 156.9
[M+K]+ 214.02648 145.0
[M+H-H2O]+ 158.06058 127.3
[M+HCOO]- 220.06152 158.5
[M+CH3COO]- 234.07717 189.0
[M+Na-2H]- 196.03799 144.9
[M]+ 175.06277 134.3
[M]- 175.06387 134.3
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