CID 51230

Cyclohexalepidin methosulfat [german]

Structural Information

Molecular Formula
C15H18N
SMILES
CC1=C2CCCCC2=[N+](C3=CC=CC=C13)C
InChI
InChI=1S/C15H18N/c1-11-12-7-3-5-9-14(12)16(2)15-10-6-4-8-13(11)15/h3,5,7,9H,4,6,8,10H2,1-2H3/q+1
InChIKey
BYIHROTXFLDONA-UHFFFAOYSA-N
Compound name
9,10-dimethyl-1,2,3,4-tetrahydroacridin-10-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

212.14392 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.151196 149.2
[M+Na]+ 235.133138 157.3
[M-H]- 211.136644 153.3
[M+NH4]+ 230.177743 168.7
[M+K]+ 251.107078 147.2
[M+H-H2O]+ 195.141180 144.4
[M+HCOO]- 257.142121 166.8
[M+CH3COO]- 271.157771 184.8
[M+Na-2H]- 233.118586 158.3
[M]+ 212.14337142 146.2
[M]- 212.14446858 146.2
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

patents stripe