CID 65531

1h-indol-2-ol

Structural Information

Molecular Formula
C8H7NO
SMILES
C1=CC=C2C(=C1)C=C(N2)O
InChI
InChI=1S/C8H7NO/c10-8-5-6-3-1-2-4-7(6)9-8/h1-5,9-10H
InChIKey
JHFAEUICJHBVHB-UHFFFAOYSA-N
Compound name
1H-indol-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

686
References

13182
Patents

133.05276 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.060036 122.4
[M+Na]+ 156.041978 132.9
[M-H]- 132.045484 123.9
[M+NH4]+ 151.086583 144.9
[M+K]+ 172.015918 128.9
[M+H-H2O]+ 116.050020 117.2
[M+HCOO]- 178.050961 145.4
[M+CH3COO]- 192.066611 137.0
[M+Na-2H]- 154.027426 131.3
[M]+ 133.05221142 121.6
[M]- 133.05330858 121.6
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.