CID 36133

Brn 2467575

Structural Information

Molecular Formula
C17H26N2O
SMILES
CCN(CC)CCNC(=O)C1CCCC2=CC=CC=C12
InChI
InChI=1S/C17H26N2O/c1-3-19(4-2)13-12-18-17(20)16-11-7-9-14-8-5-6-10-15(14)16/h5-6,8,10,16H,3-4,7,9,11-13H2,1-2H3,(H,18,20)
InChIKey
IAZRYSOMPVFZNF-UHFFFAOYSA-N
Compound name
N-[2-(diethylamino)ethyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.2045 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.21178 167.4
[M+Na]+ 297.19372 170.0
[M-H]- 273.19722 171.6
[M+NH4]+ 292.23832 184.4
[M+K]+ 313.16766 167.5
[M+H-H2O]+ 257.20176 159.5
[M+HCOO]- 319.20270 188.1
[M+CH3COO]- 333.21835 209.3
[M+Na-2H]- 295.17917 170.5
[M]+ 274.20395 166.1
[M]- 274.20505 166.1
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