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]+ 247.14411 160.1
[M+Na]+ 269.12605 168.1
[M-H]- 245.12955 162.7
[M+NH4]+ 264.17065 175.4
[M+K]+ 285.09999 165.4
[M+H-H2O]+ 229.13409 147.1
[M+HCOO]- 291.13503 178.5
[M+CH3COO]- 305.15068 208.9
[M+Na-2H]- 267.11150 160.7
[M]+ 246.13628 156.3
[M]- 246.13738 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.