CID 65335335

3,3,6-trimethyl-2,3,4,9-tetrahydro-1h-carbazole

Structural Information

Molecular Formula
C15H19N
SMILES
CC1=CC2=C(C=C1)NC3=C2CC(CC3)(C)C
InChI
InChI=1S/C15H19N/c1-10-4-5-13-11(8-10)12-9-15(2,3)7-6-14(12)16-13/h4-5,8,16H,6-7,9H2,1-3H3
InChIKey
XVLNKVMYFHFYAC-UHFFFAOYSA-N
Compound name
3,3,6-trimethyl-1,2,4,9-tetrahydrocarbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.15175 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.15903 149.1
[M+Na]+ 236.14097 159.3
[M-H]- 212.14447 152.5
[M+NH4]+ 231.18557 172.5
[M+K]+ 252.11491 153.6
[M+H-H2O]+ 196.14901 143.1
[M+HCOO]- 258.14995 168.0
[M+CH3COO]- 272.16560 162.1
[M+Na-2H]- 234.12642 154.9
[M]+ 213.15120 148.1
[M]- 213.15230 148.1
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.