CID 42663

58163-36-3

Structural Information

Molecular Formula
C19H23NO
SMILES
CN(C)[C@H]1CCC2=CC=CC=C2[C@H]1OCC3=CC=CC=C3
InChI
InChI=1S/C19H23NO/c1-20(2)18-13-12-16-10-6-7-11-17(16)19(18)21-14-15-8-4-3-5-9-15/h3-11,18-19H,12-14H2,1-2H3/t18-,19+/m0/s1
InChIKey
KOXRMQFDNIRXNA-RBUKOAKNSA-N
Compound name
(1R,2S)-N,N-dimethyl-1-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.17798 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.185256 167.0
[M+Na]+ 304.167198 171.7
[M-H]- 280.170704 174.8
[M+NH4]+ 299.211803 183.8
[M+K]+ 320.141138 168.2
[M+H-H2O]+ 264.175240 158.1
[M+HCOO]- 326.176181 188.2
[M+CH3COO]- 340.191831 207.9
[M+Na-2H]- 302.152646 171.6
[M]+ 281.17743142 166.2
[M]- 281.17852858 166.2
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.