CID 3054414

Morpholine, 2-((1h-inden-4(or 7)-yloxy)methyl)-4-isopropyl-

Structural Information

Molecular Formula
C17H23NO2
SMILES
CC(C)N1CCOC(C1)COC2=CC=CC3=C2C=CC3
InChI
InChI=1S/C17H23NO2/c1-13(2)18-9-10-19-15(11-18)12-20-17-8-4-6-14-5-3-7-16(14)17/h3-4,6-8,13,15H,5,9-12H2,1-2H3
InChIKey
YFDFXQFRLVHLOA-UHFFFAOYSA-N
Compound name
2-(1H-inden-4-yloxymethyl)-4-propan-2-ylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.17288 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.18016 165.7
[M+Na]+ 296.16210 170.8
[M-H]- 272.16560 171.6
[M+NH4]+ 291.20670 181.8
[M+K]+ 312.13604 168.6
[M+H-H2O]+ 256.17014 157.7
[M+HCOO]- 318.17108 182.5
[M+CH3COO]- 332.18673 199.3
[M+Na-2H]- 294.14755 167.4
[M]+ 273.17233 165.1
[M]- 273.17343 165.1
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