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]+ 282.18526 167.0
[M+Na]+ 304.16720 171.7
[M-H]- 280.17070 174.8
[M+NH4]+ 299.21180 183.8
[M+K]+ 320.14114 168.2
[M+H-H2O]+ 264.17524 158.1
[M+HCOO]- 326.17618 188.2
[M+CH3COO]- 340.19183 207.9
[M+Na-2H]- 302.15265 171.6
[M]+ 281.17743 166.2
[M]- 281.17853 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.