CID 200003

Dtxsid90969859

Structural Information

Molecular Formula
C13H17NO2
SMILES
C1COCCN1C2C(CC3=CC=CC=C23)O
InChI
InChI=1S/C13H17NO2/c15-12-9-10-3-1-2-4-11(10)13(12)14-5-7-16-8-6-14/h1-4,12-13,15H,5-9H2
InChIKey
UCJXADGXNWEUQA-UHFFFAOYSA-N
Compound name
1-morpholin-4-yl-2,3-dihydro-1H-inden-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

219.12593 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.133206 148.3
[M+Na]+ 242.115148 154.1
[M-H]- 218.118654 153.1
[M+NH4]+ 237.159753 166.0
[M+K]+ 258.089088 151.6
[M+H-H2O]+ 202.123190 141.3
[M+HCOO]- 264.124131 164.6
[M+CH3COO]- 278.139781 159.9
[M+Na-2H]- 240.100596 152.1
[M]+ 219.12538142 143.8
[M]- 219.12647858 143.8
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.