CID 207707

Benzamide, 5-amino-n,n-diethyl-2-(2-propynyloxy)-, hydrochloride

Structural Information

Molecular Formula
C14H18N2O2
SMILES
CCN(CC)C(=O)C1=C(C=CC(=C1)N)OCC#C
InChI
InChI=1S/C14H18N2O2/c1-4-9-18-13-8-7-11(15)10-12(13)14(17)16(5-2)6-3/h1,7-8,10H,5-6,9,15H2,2-3H3
InChIKey
RCVLCYUWCNFKAH-UHFFFAOYSA-N
Compound name
5-amino-N,N-diethyl-2-prop-2-ynoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.13683 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.144106 160.1
[M+Na]+ 269.126048 168.1
[M-H]- 245.129554 162.7
[M+NH4]+ 264.170653 175.4
[M+K]+ 285.099988 165.4
[M+H-H2O]+ 229.134090 147.1
[M+HCOO]- 291.135031 178.5
[M+CH3COO]- 305.150681 208.9
[M+Na-2H]- 267.111496 160.7
[M]+ 246.13628142 156.3
[M]- 246.13737858 156.3
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

No patent data available for this compound.