CID 11137361

1-(3,6-dihydro-2h-pyran-4-yl)pyrrolidine

Structural Information

Molecular Formula
C9H15NO
SMILES
C1CCN(C1)C2=CCOCC2
InChI
InChI=1S/C9H15NO/c1-2-6-10(5-1)9-3-7-11-8-4-9/h3H,1-2,4-8H2
InChIKey
MYXXCWHPWZMVIO-UHFFFAOYSA-N
Compound name
1-(3,6-dihydro-2H-pyran-4-yl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

153.11537 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 134.3
[M+Na]+ 176.10459 145.3
[M+NH4]+ 171.14919 143.8
[M+K]+ 192.07853 140.8
[M-H]- 152.10809 138.8
[M+Na-2H]- 174.09004 140.3
[M]+ 153.11482 137.0
[M]- 153.11592 137.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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