CID 3033040

1-naphthamide, 1,2,3,4-tetrahydro-4-(dimethylamino)-n,n-dimethyl-1-phenyl-, hydrochloride, (e)-

Structural Information

Molecular Formula
C21H26N2O
SMILES
CN(C)[C@@H]1CCC(C2=CC=CC=C12)(C3=CC=CC=C3)C(=O)N(C)C
InChI
InChI=1S/C21H26N2O/c1-22(2)19-14-15-21(20(24)23(3)4,16-10-6-5-7-11-16)18-13-9-8-12-17(18)19/h5-13,19H,14-15H2,1-4H3/t19-,21?/m1/s1
InChIKey
RCOLOZHDHDDROC-YMBRHYMPSA-N
Compound name
(4R)-4-(dimethylamino)-N,N-dimethyl-1-phenyl-3,4-dihydro-2H-naphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.2045 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.211776 178.9
[M+Na]+ 345.193718 183.1
[M-H]- 321.197224 188.1
[M+NH4]+ 340.238323 196.3
[M+K]+ 361.167658 180.9
[M+H-H2O]+ 305.201760 169.9
[M+HCOO]- 367.202701 200.1
[M+CH3COO]- 381.218351 221.1
[M+Na-2H]- 343.179166 182.0
[M]+ 322.20395142 178.3
[M]- 322.20504858 178.3
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.