CID 45876

63978-97-2

Structural Information

Molecular Formula
C15H20ClNO
SMILES
CN(C)C1CCCC2=C(C=CC(=C12)Cl)OCC=C
InChI
InChI=1S/C15H20ClNO/c1-4-10-18-14-9-8-12(16)15-11(14)6-5-7-13(15)17(2)3/h4,8-9,13H,1,5-7,10H2,2-3H3
InChIKey
LNORLYYKYFJOAF-UHFFFAOYSA-N
Compound name
8-chloro-N,N-dimethyl-5-prop-2-enoxy-1,2,3,4-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.12335 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.13063 159.4
[M+Na]+ 288.11257 172.8
[M+NH4]+ 283.15717 169.1
[M+K]+ 304.08651 164.2
[M-H]- 264.11607 163.5
[M+Na-2H]- 286.09802 165.3
[M]+ 265.12280 162.8
[M]- 265.12390 162.8
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.