CID 4650705

145510-96-9

Structural Information

Molecular Formula
C19H19NO
SMILES
CC1=C(C=C(C=C1)NCC2=C(C=CC3=CC=CC=C32)O)C
InChI
InChI=1S/C19H19NO/c1-13-7-9-16(11-14(13)2)20-12-18-17-6-4-3-5-15(17)8-10-19(18)21/h3-11,20-21H,12H2,1-2H3
InChIKey
YGXSUYQUAYAMQZ-UHFFFAOYSA-N
Compound name
1-[(3,4-dimethylanilino)methyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.14667 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.153946 164.9
[M+Na]+ 300.135888 173.2
[M-H]- 276.139394 171.6
[M+NH4]+ 295.180493 181.5
[M+K]+ 316.109828 167.2
[M+H-H2O]+ 260.143930 157.1
[M+HCOO]- 322.144871 187.0
[M+CH3COO]- 336.160521 176.7
[M+Na-2H]- 298.121336 170.5
[M]+ 277.14612142 164.9
[M]- 277.14721858 164.9
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.