CID 68954

Naftypramide

Structural Information

Molecular Formula
C19H26N2O
SMILES
CC(C)C(CCN(C)C)(C1=CC=CC2=CC=CC=C21)C(=O)N
InChI
InChI=1S/C19H26N2O/c1-14(2)19(18(20)22,12-13-21(3)4)17-11-7-9-15-8-5-6-10-16(15)17/h5-11,14H,12-13H2,1-4H3,(H2,20,22)
InChIKey
XXFVRXJPEIBBEZ-UHFFFAOYSA-N
Compound name
2-[2-(dimethylamino)ethyl]-3-methyl-2-naphthalen-1-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

27
Patents

298.2045 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.211776 174.5
[M+Na]+ 321.193718 178.4
[M-H]- 297.197224 179.0
[M+NH4]+ 316.238323 190.4
[M+K]+ 337.167658 175.9
[M+H-H2O]+ 281.201760 167.1
[M+HCOO]- 343.202701 194.3
[M+CH3COO]- 357.218351 215.9
[M+Na-2H]- 319.179166 177.2
[M]+ 298.20395142 174.9
[M]- 298.20504858 174.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe