CID 44247

Ppr 493

Structural Information

Molecular Formula
C16H27N3O
SMILES
CCN(CC)CCN=C(C1=CC=C(C=C1)OC(C)C)N
InChI
InChI=1S/C16H27N3O/c1-5-19(6-2)12-11-18-16(17)14-7-9-15(10-8-14)20-13(3)4/h7-10,13H,5-6,11-12H2,1-4H3,(H2,17,18)
InChIKey
RHKAJQAIEVKRTO-UHFFFAOYSA-N
Compound name
N'-[2-(diethylamino)ethyl]-4-propan-2-yloxybenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.21542 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.222696 171.7
[M+Na]+ 300.204638 174.8
[M-H]- 276.208144 176.7
[M+NH4]+ 295.249243 187.9
[M+K]+ 316.178578 174.1
[M+H-H2O]+ 260.212680 163.3
[M+HCOO]- 322.213621 196.7
[M+CH3COO]- 336.229271 216.0
[M+Na-2H]- 298.190086 172.4
[M]+ 277.21487142 173.8
[M]- 277.21596858 173.8
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.