CID 3048854

12h-acenaphtho(4,5-a)carbazole, 9-methyl-

Structural Information

Molecular Formula
C23H15N
SMILES
CC1=CC2=C(C=C1)NC3=C2C=CC4=C3C=C5C=CC6=C5C4=CC=C6
InChI
InChI=1S/C23H15N/c1-13-5-10-21-19(11-13)18-9-8-16-17-4-2-3-14-6-7-15(22(14)17)12-20(16)23(18)24-21/h2-12,24H,1H3
InChIKey
OCGNZSNITQDXLK-UHFFFAOYSA-N
Compound name
8-methyl-12-azahexacyclo[14.6.1.02,14.05,13.06,11.019,23]tricosa-1(22),2(14),3,5(13),6(11),7,9,15,17,19(23),20-undecaene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.12045 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.12773 170.6
[M+Na]+ 328.10967 183.9
[M-H]- 304.11317 177.6
[M+NH4]+ 323.15427 192.7
[M+K]+ 344.08361 174.4
[M+H-H2O]+ 288.11771 163.2
[M+HCOO]- 350.11865 190.4
[M+CH3COO]- 364.13430 183.3
[M+Na-2H]- 326.09512 177.1
[M]+ 305.11990 175.6
[M]- 305.12100 175.6
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.