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

63
Patents

147.06842 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.07570 127.0
[M+Na]+ 170.05764 138.0
[M-H]- 146.06114 128.7
[M+NH4]+ 165.10224 149.3
[M+K]+ 186.03158 133.8
[M+H-H2O]+ 130.06568 121.9
[M+HCOO]- 192.06662 149.7
[M+CH3COO]- 206.08227 141.5
[M+Na-2H]- 168.04309 134.6
[M]+ 147.06787 127.0
[M]- 147.06897 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