CID 3049635

2-((1h-inden-4(or 7)-yloxy)methyl)morpholine

Structural Information

Molecular Formula
C14H17NO2
SMILES
C1COC(CN1)COC2=CC=CC3=C2C=CC3
InChI
InChI=1S/C14H17NO2/c1-3-11-4-2-6-14(13(11)5-1)17-10-12-9-15-7-8-16-12/h1-2,4-6,12,15H,3,7-10H2
InChIKey
NWINIMXDTPZGDL-UHFFFAOYSA-N
Compound name
2-(1H-inden-4-yloxymethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

231.12593 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.13321 150.9
[M+Na]+ 254.11515 156.3
[M-H]- 230.11865 155.5
[M+NH4]+ 249.15975 167.8
[M+K]+ 270.08909 153.5
[M+H-H2O]+ 214.12319 143.4
[M+HCOO]- 276.12413 168.3
[M+CH3COO]- 290.13978 162.2
[M+Na-2H]- 252.10060 155.9
[M]+ 231.12538 147.7
[M]- 231.12648 147.7
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