CID 2794664

2,3-dihydro-1h-indol-2-ylmethanol

Structural Information

Molecular Formula
C9H11NO
SMILES
C1C(NC2=CC=CC=C21)CO
InChI
InChI=1S/C9H11NO/c11-6-8-5-7-3-1-2-4-9(7)10-8/h1-4,8,10-11H,5-6H2
InChIKey
GRPOFAKYHPAXNP-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-indol-2-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

354
Patents

149.08406 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.091336 130.2
[M+Na]+ 172.073278 138.1
[M-H]- 148.076784 130.7
[M+NH4]+ 167.117883 151.8
[M+K]+ 188.047218 134.4
[M+H-H2O]+ 132.081320 124.7
[M+HCOO]- 194.082261 150.0
[M+CH3COO]- 208.097911 143.2
[M+Na-2H]- 170.058726 136.5
[M]+ 149.08351142 126.8
[M]- 149.08460858 126.8
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