CID 29329

Ethylamine, 2-((9,10-ethanoanthracen-9(10h)-yl)methoxy)-n,n-dimethyl-, hydrochloride

Structural Information

Molecular Formula
C21H25NO
SMILES
CN(C)CCOCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24
InChI
InChI=1S/C21H25NO/c1-22(2)13-14-23-15-21-12-11-16(17-7-3-5-9-19(17)21)18-8-4-6-10-20(18)21/h3-10,16H,11-15H2,1-2H3
InChIKey
IKVVTKWBVSQEGL-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethoxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.1936 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.20088 172.7
[M+Na]+ 330.18282 176.1
[M-H]- 306.18632 175.3
[M+NH4]+ 325.22742 194.0
[M+K]+ 346.15676 171.9
[M+H-H2O]+ 290.19086 162.8
[M+HCOO]- 352.19180 186.3
[M+CH3COO]- 366.20745 181.8
[M+Na-2H]- 328.16827 182.2
[M]+ 307.19305 176.4
[M]- 307.19415 176.5
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

No patent data available for this compound.