CID 14225079

6-methoxy-3-methyl-2,3,4,9-tetrahydro-1h-carbazole

Structural Information

Molecular Formula
C14H17NO
SMILES
CC1CCC2=C(C1)C3=C(N2)C=CC(=C3)OC
InChI
InChI=1S/C14H17NO/c1-9-3-5-13-11(7-9)12-8-10(16-2)4-6-14(12)15-13/h4,6,8-9,15H,3,5,7H2,1-2H3
InChIKey
FZDFKOCDPZVWTO-UHFFFAOYSA-N
Compound name
6-methoxy-3-methyl-2,3,4,9-tetrahydro-1H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.13101 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.13829 147.6
[M+Na]+ 238.12023 157.0
[M-H]- 214.12373 150.7
[M+NH4]+ 233.16483 168.7
[M+K]+ 254.09417 152.0
[M+H-H2O]+ 198.12827 141.3
[M+HCOO]- 260.12921 166.9
[M+CH3COO]- 274.14486 160.4
[M+Na-2H]- 236.10568 153.0
[M]+ 215.13046 147.4
[M]- 215.13156 147.4
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.