CID 10844525

1-methyl-1h-indol-5-ol

Structural Information

Molecular Formula
C9H9NO
SMILES
CN1C=CC2=C1C=CC(=C2)O
InChI
InChI=1S/C9H9NO/c1-10-5-4-7-6-8(11)2-3-9(7)10/h2-6,11H,1H3
InChIKey
FNNWTXMUBMHNOD-UHFFFAOYSA-N
Compound name
1-methylindol-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

215
Patents

147.06842 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.075696 126.4
[M+Na]+ 170.057638 137.8
[M-H]- 146.061144 129.5
[M+NH4]+ 165.102243 149.3
[M+K]+ 186.031578 134.5
[M+H-H2O]+ 130.065680 121.0
[M+HCOO]- 192.066621 150.6
[M+CH3COO]- 206.082271 141.6
[M+Na-2H]- 168.043086 134.5
[M]+ 147.06787142 128.2
[M]- 147.06896858 128.2
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