CID 266109

6-methyl-1,2,3,4-tetrahydrocarbazole

Structural Information

Molecular Formula
C13H15N
SMILES
CC1=CC2=C(C=C1)NC3=C2CCCC3
InChI
InChI=1S/C13H15N/c1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h6-8,14H,2-5H2,1H3
InChIKey
BMBRPEXJJPILQP-UHFFFAOYSA-N
Compound name
6-methyl-2,3,4,9-tetrahydro-1H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

185.12045 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.127726 139.4
[M+Na]+ 208.109668 148.5
[M-H]- 184.113174 142.3
[M+NH4]+ 203.154273 161.5
[M+K]+ 224.083608 143.2
[M+H-H2O]+ 168.117710 133.3
[M+HCOO]- 230.118651 159.0
[M+CH3COO]- 244.134301 152.5
[M+Na-2H]- 206.095116 146.1
[M]+ 185.11990142 137.1
[M]- 185.12099858 137.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe