CID 18932734

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

Structural Information

Molecular Formula
C9H9NO
SMILES
CC1=CC(=CC2=C1NC=C2)O
InChI
InChI=1S/C9H9NO/c1-6-4-8(11)5-7-2-3-10-9(6)7/h2-5,10-11H,1H3
InChIKey
IGYHZJNICRWVJU-UHFFFAOYSA-N
Compound name
7-methyl-1H-indol-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

147.06842 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.075696 127.0
[M+Na]+ 170.057638 138.0
[M-H]- 146.061144 128.7
[M+NH4]+ 165.102243 149.3
[M+K]+ 186.031578 133.8
[M+H-H2O]+ 130.065680 121.9
[M+HCOO]- 192.066621 149.7
[M+CH3COO]- 206.082271 141.5
[M+Na-2H]- 168.043086 134.6
[M]+ 147.06787142 127.0
[M]- 147.06896858 127.0
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

patents stripe