CID 3061087

N,n-dimethyl-4-phenyl-1-oxaspiro(4.5)decane-3-methanamine hydrochloride

Structural Information

Molecular Formula
C18H27NO
SMILES
CN(C)CC1COC2(C1C3=CC=CC=C3)CCCCC2
InChI
InChI=1S/C18H27NO/c1-19(2)13-16-14-20-18(11-7-4-8-12-18)17(16)15-9-5-3-6-10-15/h3,5-6,9-10,16-17H,4,7-8,11-14H2,1-2H3
InChIKey
OEBFKVOYRDTUGY-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(4-phenyl-1-oxaspiro[4.5]decan-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

273.20926 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.21654 168.6
[M+Na]+ 296.19848 179.5
[M+NH4]+ 291.24308 179.9
[M+K]+ 312.17242 171.7
[M-H]- 272.20198 176.4
[M+Na-2H]- 294.18393 176.5
[M]+ 273.20871 172.5
[M]- 273.20981 172.5
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

patents stripe