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]+ 213.15120 149.2
[M+Na]+ 235.13314 157.3
[M-H]- 211.13664 153.3
[M+NH4]+ 230.17774 168.7
[M+K]+ 251.10708 147.2
[M+H-H2O]+ 195.14118 144.4
[M+HCOO]- 257.14212 166.8
[M+CH3COO]- 271.15777 184.8
[M+Na-2H]- 233.11859 158.3
[M]+ 212.14337 146.2
[M]- 212.14447 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